methyl 3-[(4-cyanophenyl)methylamino]-2-methyl-benzoate

Systemtic Name: methyl 3-[(4-cyanophenyl)methylamino]-2-methyl-benzoate Openeye Name: methyl 3-[(4-cyanophenyl)methylamino]-2-methyl-benzoate CAS Name: 3-[(4-cyanophenyl)methylamino]-2-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[(4-cyanophenyl)methylamino]-2-methylbenzoate Traditional Name: 3-[(4-cyanobenzyl)amino]-2-methyl-benzoic acid methyl ester Formula: C17H16N2O2 MolecularWeight: 280.32114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NCC2=CC=C(C=C2)C#N)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1NCC2=CC=C(C=C2)C#N)C(=O)OC

InChI

InChI=1S/C17H16N2O2/c1-12-15(17(20)21-2)4-3-5-16(12)19-11-14-8-6-13(10-18)7-9-14/h3-9,19H,11H2,1-2H3