4-[[[1-[methyl-(phenylmethyl)amino]-2-oxidanyl-2-oxidanylidene-ethylidene]amino]methyl]benzoic acid

Systemtic Name: 4-[[[1-[methyl-(phenylmethyl)amino]-2-oxidanyl-2-oxidanylidene-ethylidene]amino]methyl]benzoic acid Openeye Name: 4-[[[1-[benzyl(methyl)amino]-2-hydroxy-2-oxo-ethylidene]amino]methyl]benzoic acid CAS Name: 4-[[[2-hydroxy-1-[methyl-(phenylmethyl)amino]-2-oxoethylidene]amino]methyl]benzoic acid IUPAC Name: 4-[[[1-[benzyl(methyl)amino]-2-hydroxy-2-oxoethylidene]amino]methyl]benzoic acid Traditional Name: 4-[[[1-[benzyl(methyl)amino]-2-hydroxy-2-keto-ethylidene]amino]methyl]benzoic acid Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=NCC2=CC=C(C=C2)C(=O)O)C(=O)O

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=NCC2=CC=C(C=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C18H18N2O4/c1-20(12-14-5-3-2-4-6-14)16(18(23)24)19-11-13-7-9-15(10-8-13)17(21)22/h2-10H,11-12H2,1H3,(H,21,22)(H,23,24)