2-[[2-[4-(3-hydroxyphenyl)-3,4-dimethyl-piperidin-1-yl]-2-phenyl-butanoyl]amino]ethanoic acid

Systemtic Name: 2-[[2-[4-(3-hydroxyphenyl)-3,4-dimethyl-piperidin-1-yl]-2-phenyl-butanoyl]amino]ethanoic acid Openeye Name: 2-[[2-[4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidyl]-2-phenyl-butanoyl]amino]acetic acid CAS Name: 2-[[2-[4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidinyl]-1-oxo-2-phenylbutyl]amino]acetic acid IUPAC Name: 2-[[2-[4-(3-hydroxyphenyl)-3,4-dimethylpiperidin-1-yl]-2-phenylbutanoyl]amino]acetic acid Traditional Name: 2-[[2-[4-(3-hydroxyphenyl)-3,4-dimethyl-piperidino]-2-phenyl-butanoyl]amino]acetic acid Formula: C25H32N2O4 MolecularWeight: 424.53258

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)(C(=O)NCC(=O)O)N2CCC(C(C2)C)(C)C3=CC(=CC=C3)O

Isomeric SMILES

CCC(C1=CC=CC=C1)(C(=O)NCC(=O)O)N2CCC(C(C2)C)(C)C3=CC(=CC=C3)O

InChI

InChI=1S/C25H32N2O4/c1-4-25(19-9-6-5-7-10-19,23(31)26-16-22(29)30)27-14-13-24(3,18(2)17-27)20-11-8-12-21(28)15-20/h5-12,15,18,28H,4,13-14,16-17H2,1-3H3,(H,26,31)(H,29,30)