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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NCC2=CC=CC(=C2)C#N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NCC2=CC=CC(=C2)C#N

InChI

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