4-[(1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl)amino]-3-[(4-methoxy-3-oxidanyl-phenyl)methylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl)amino]-3-[(4-methoxy-3-oxidanyl-phenyl)methylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(1-benzyl-2-methoxy-2-oxo-ethyl)amino]-3-[(3-hydroxy-4-methoxy-phenyl)methylamino]-4-oxo-butanoic acid CAS Name: 3-[(3-hydroxy-4-methoxyphenyl)methylamino]-4-[(1-methoxy-1-oxo-3-phenylpropan-2-yl)amino]-4-oxobutanoic acid IUPAC Name: 3-[(3-hydroxy-4-methoxyphenyl)methylamino]-4-[(1-methoxy-1-oxo-3-phenylpropan-2-yl)amino]-4-oxobutanoic acid Traditional Name: 4-[(1-benzyl-2-keto-2-methoxy-ethyl)amino]-3-[(3-hydroxy-4-methoxy-benzyl)amino]-4-keto-butyric acid Formula: C22H26N2O7 MolecularWeight: 430.45104

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(CC(=O)O)C(=O)NC(CC2=CC=CC=C2)C(=O)OC)O

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(CC(=O)O)C(=O)NC(CC2=CC=CC=C2)C(=O)OC)O

InChI

InChI=1S/C22H26N2O7/c1-30-19-9-8-15(11-18(19)25)13-23-16(12-20(26)27)21(28)24-17(22(29)31-2)10-14-6-4-3-5-7-14/h3-9,11,16-17,23,25H,10,12-13H2,1-2H3,(H,24,28)(H,26,27)