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20723-85-7 | Benzoic acid, 2-[(2,3-dimethylphenyl)amino]-, 2-methoxyphenyl ester
CAS No: 20723-85-7 Catalog No: AG002IXB MDL No:
Product Description
Catalog Number:
AG002IXB
Chemical Name:
Benzoic acid, 2-[(2,3-dimethylphenyl)amino]-, 2-methoxyphenyl ester
CAS Number:
20723-85-7
Molecular Formula:
C22H21NO3
Molecular Weight:
347.4070
IUPAC Name:
(2-methoxyphenyl) 2-(2,3-dimethylanilino)benzoate
InChI:
InChI=1S/C22H21NO3/c1-15-9-8-12-18(16(15)2)23-19-11-5-4-10-17(19)22(24)26-21-14-7-6-13-20(21)25-3/h4-14,23H,1-3H3
InChI Key:
QAVPLSMHPGKHQO-UHFFFAOYSA-N
SMILES:
COc1ccccc1OC(=O)c1ccccc1Nc1cccc(c1C)C
Properties
Complexity:
455
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
347.152g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
347.414g/mol
Monoisotopic Mass:
347.152g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7
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