2-[[4-(3-hydroxyphenyl)-3-methyl-2-phenyl-4-piperidin-1-yl-pentanoyl]amino]ethanoic acid

Systemtic Name: 2-[[4-(3-hydroxyphenyl)-3-methyl-2-phenyl-4-piperidin-1-yl-pentanoyl]amino]ethanoic acid Openeye Name: 2-[[4-(3-hydroxyphenyl)-3-methyl-2-phenyl-4-(1-piperidyl)pentanoyl]amino]acetic acid CAS Name: 2-[[4-(3-hydroxyphenyl)-3-methyl-1-oxo-2-phenyl-4-(1-piperidinyl)pentyl]amino]acetic acid IUPAC Name: 2-[[4-(3-hydroxyphenyl)-3-methyl-2-phenyl-4-piperidin-1-ylpentanoyl]amino]acetic acid Traditional Name: 2-[[4-(3-hydroxyphenyl)-3-methyl-2-phenyl-4-piperidino-pentanoyl]amino]acetic acid Formula: C25H32N2O4 MolecularWeight: 424.53258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)C(=O)NCC(=O)O)C(C)(C2=CC(=CC=C2)O)N3CCCCC3

Isomeric SMILES

CC(C(C1=CC=CC=C1)C(=O)NCC(=O)O)C(C)(C2=CC(=CC=C2)O)N3CCCCC3

InChI

InChI=1S/C25H32N2O4/c1-18(23(19-10-5-3-6-11-19)24(31)26-17-22(29)30)25(2,27-14-7-4-8-15-27)20-12-9-13-21(28)16-20/h3,5-6,9-13,16,18,23,28H,4,7-8,14-15,17H2,1-2H3,(H,26,31)(H,29,30)