methyl 3-[(3-methoxy-4-oxidanyl-phenyl)methylamino]benzoate

Systemtic Name: methyl 3-[(3-methoxy-4-oxidanyl-phenyl)methylamino]benzoate Openeye Name: methyl 3-[(4-hydroxy-3-methoxy-phenyl)methylamino]benzoate CAS Name: 3-[(4-hydroxy-3-methoxyphenyl)methylamino]benzoic acid methyl ester IUPAC Name: methyl 3-[(4-hydroxy-3-methoxyphenyl)methylamino]benzoate Traditional Name: 3-(vanillylamino)benzoic acid methyl ester Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC2=CC=CC(=C2)C(=O)OC)O

Isomeric SMILES

COC1=C(C=CC(=C1)CNC2=CC=CC(=C2)C(=O)OC)O

InChI

InChI=1S/C16H17NO4/c1-20-15-8-11(6-7-14(15)18)10-17-13-5-3-4-12(9-13)16(19)21-2/h3-9,17-18H,10H2,1-2H3