4-azanyl-4-[3-[(3-methoxyphenyl)carbonylamino]phenyl]azaniumylidene-butanoate

Systemtic Name: 4-azanyl-4-[3-[(3-methoxyphenyl)carbonylamino]phenyl]azaniumylidene-butanoate Openeye Name: 4-amino-4-[3-[(3-methoxybenzoyl)amino]phenyl]iminio-butanoate CAS Name: 4-amino-4-[3-[[(3-methoxyphenyl)-oxomethyl]amino]phenyl]iminiobutanoate IUPAC Name: 4-amino-4-[3-[(3-methoxybenzoyl)amino]phenyl]azaniumylidenebutanoate Traditional Name: 4-amino-4-[3-(m-anisoylamino)phenyl]iminio-butyrate Formula: C18H19N3O4 MolecularWeight: 341.36116

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC2=CC(=CC=C2)[NH+]=C(CCC(=O)[O-])N

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC2=CC(=CC=C2)[NH+]=C(CCC(=O)[O-])N

InChI

InChI=1S/C18H19N3O4/c1-25-15-7-2-4-12(10-15)18(24)21-14-6-3-5-13(11-14)20-16(19)8-9-17(22)23/h2-7,10-11H,8-9H2,1H3,(H2,19,20)(H,21,24)(H,22,23)