3-[(3-methoxy-2-oxidanyl-phenyl)methylamino]-4-methyl-benzoate

Systemtic Name: 3-[(3-methoxy-2-oxidanyl-phenyl)methylamino]-4-methyl-benzoate Openeye Name: 3-[(2-hydroxy-3-methoxy-phenyl)methylamino]-4-methyl-benzoate CAS Name: 3-[(2-hydroxy-3-methoxyphenyl)methylamino]-4-methylbenzoate IUPAC Name: 3-[(2-hydroxy-3-methoxyphenyl)methylamino]-4-methylbenzoate Traditional Name: 3-[(2-hydroxy-3-methoxy-benzyl)amino]-4-methyl-benzoate Formula: C16H16NO4- MolecularWeight: 286.30254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])NCC2=C(C(=CC=C2)OC)O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])NCC2=C(C(=CC=C2)OC)O

InChI

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