3-[(3-methoxy-3-oxidanylidene-propanoyl)amino]-2-[(phenylmethyl)amino]benzoic acid

Systemtic Name: 3-[(3-methoxy-3-oxidanylidene-propanoyl)amino]-2-[(phenylmethyl)amino]benzoic acid Openeye Name: 2-(benzylamino)-3-[(3-methoxy-3-oxo-propanoyl)amino]benzoic acid CAS Name: 3-[(3-methoxy-1,3-dioxopropyl)amino]-2-[(phenylmethyl)amino]benzoic acid IUPAC Name: 2-(benzylamino)-3-[(3-methoxy-3-oxopropanoyl)amino]benzoic acid Traditional Name: 2-(benzylamino)-3-[(3-keto-3-methoxy-propanoyl)amino]benzoic acid Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(=O)NC1=CC=CC(=C1NCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

COC(=O)CC(=O)NC1=CC=CC(=C1NCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H18N2O5/c1-25-16(22)10-15(21)20-14-9-5-8-13(18(23)24)17(14)19-11-12-6-3-2-4-7-12/h2-9,19H,10-11H2,1H3,(H,20,21)(H,23,24)