4-[4-[[(4-methoxy-4-oxidanylidene-butanoyl)-(3-phenylpropyl)amino]methyl]phenoxy]butanoic acid

Systemtic Name: 4-[4-[[(4-methoxy-4-oxidanylidene-butanoyl)-(3-phenylpropyl)amino]methyl]phenoxy]butanoic acid Openeye Name: 4-[4-[[(4-methoxy-4-oxo-butanoyl)-(3-phenylpropyl)amino]methyl]phenoxy]butanoic acid CAS Name: 4-[4-[[(4-methoxy-1,4-dioxobutyl)-(3-phenylpropyl)amino]methyl]phenoxy]butanoic acid IUPAC Name: 4-[4-[[(4-methoxy-4-oxobutanoyl)-(3-phenylpropyl)amino]methyl]phenoxy]butanoic acid Traditional Name: 4-[4-[[(4-keto-4-methoxy-butanoyl)-(3-phenylpropyl)amino]methyl]phenoxy]butyric acid Formula: C25H31NO6 MolecularWeight: 441.51674

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)N(CCCC1=CC=CC=C1)CC2=CC=C(C=C2)OCCCC(=O)O

Isomeric SMILES

COC(=O)CCC(=O)N(CCCC1=CC=CC=C1)CC2=CC=C(C=C2)OCCCC(=O)O

InChI

InChI=1S/C25H31NO6/c1-31-25(30)16-15-23(27)26(17-5-9-20-7-3-2-4-8-20)19-21-11-13-22(14-12-21)32-18-6-10-24(28)29/h2-4,7-8,11-14H,5-6,9-10,15-19H2,1H3,(H,28,29)