4-[(3-butoxy-4-methoxy-phenyl)methylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(3-butoxy-4-methoxy-phenyl)methylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(3-butoxy-4-methoxy-phenyl)methylamino]-4-oxo-butanoic acid CAS Name: 4-[(3-butoxy-4-methoxyphenyl)methylamino]-4-oxobutanoic acid IUPAC Name: 4-[(3-butoxy-4-methoxyphenyl)methylamino]-4-oxobutanoic acid Traditional Name: 4-[(3-butoxy-4-methoxy-benzyl)amino]-4-keto-butyric acid Formula: C16H23NO5 MolecularWeight: 309.35752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)CNC(=O)CCC(=O)O)OC

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)CNC(=O)CCC(=O)O)OC

InChI

InChI=1S/C16H23NO5/c1-3-4-9-22-14-10-12(5-6-13(14)21-2)11-17-15(18)7-8-16(19)20/h5-6,10H,3-4,7-9,11H2,1-2H3,(H,17,18)(H,19,20)