2-methyl-5-[4-[3-oxidanylbutyl-(4-phenylmethoxyphenyl)amino]piperidin-1-yl]-5-oxidanylidene-pentanamide

Systemtic Name: 2-methyl-5-[4-[3-oxidanylbutyl-(4-phenylmethoxyphenyl)amino]piperidin-1-yl]-5-oxidanylidene-pentanamide Openeye Name: 5-[4-[4-benzyloxy-N-(3-hydroxybutyl)anilino]-1-piperidyl]-2-methyl-5-oxo-pentanamide CAS Name: 5-[4-[N-(3-hydroxybutyl)-4-phenylmethoxyanilino]-1-piperidinyl]-2-methyl-5-oxopentanamide IUPAC Name: 5-[4-[N-(3-hydroxybutyl)-4-phenylmethoxyanilino]piperidin-1-yl]-2-methyl-5-oxopentanamide Traditional Name: 5-[4-[4-benzoxy-N-(3-hydroxybutyl)anilino]piperidino]-5-keto-2-methyl-valeramide Formula: C28H39N3O4 MolecularWeight: 481.62696

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)N1CCC(CC1)N(CCC(C)O)C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)N

Isomeric SMILES

CC(CCC(=O)N1CCC(CC1)N(CCC(C)O)C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C28H39N3O4/c1-21(28(29)34)8-13-27(33)30-17-15-25(16-18-30)31(19-14-22(2)32)24-9-11-26(12-10-24)35-20-23-6-4-3-5-7-23/h3-7,9-12,21-22,25,32H,8,13-20H2,1-2H3,(H2,29,34)