4-[[1-(3,4-dimethoxyphenyl)-3-methoxy-3-oxidanylidene-propyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[1-(3,4-dimethoxyphenyl)-3-methoxy-3-oxidanylidene-propyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[1-(3,4-dimethoxyphenyl)-3-methoxy-3-oxo-propyl]amino]-4-oxo-butanoic acid CAS Name: 4-[[1-(3,4-dimethoxyphenyl)-3-methoxy-3-oxopropyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[1-(3,4-dimethoxyphenyl)-3-methoxy-3-oxopropyl]amino]-4-oxobutanoic acid Traditional Name: 4-[[1-(3,4-dimethoxyphenyl)-3-keto-3-methoxy-propyl]amino]-4-keto-butyric acid Formula: C16H21NO7 MolecularWeight: 339.34044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC(=O)OC)NC(=O)CCC(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CC(=O)OC)NC(=O)CCC(=O)O)OC

InChI

InChI=1S/C16H21NO7/c1-22-12-5-4-10(8-13(12)23-2)11(9-16(21)24-3)17-14(18)6-7-15(19)20/h4-5,8,11H,6-7,9H2,1-3H3,(H,17,18)(H,19,20)