4-methyl-2-(3-methylbutylamino)-1-[4-[3-methylbutyl-(4-phenylmethoxyphenyl)amino]piperidin-1-yl]pentan-1-one

Systemtic Name: 4-methyl-2-(3-methylbutylamino)-1-[4-[3-methylbutyl-(4-phenylmethoxyphenyl)amino]piperidin-1-yl]pentan-1-one Openeye Name: 1-[4-(4-benzyloxy-N-isopentyl-anilino)-1-piperidyl]-2-(isopentylamino)-4-methyl-pentan-1-one CAS Name: 4-methyl-2-(3-methylbutylamino)-1-[4-[N-(3-methylbutyl)-4-phenylmethoxyanilino]-1-piperidinyl]-1-pentanone IUPAC Name: 4-methyl-2-(3-methylbutylamino)-1-[4-[N-(3-methylbutyl)-4-phenylmethoxyanilino]piperidin-1-yl]pentan-1-one Traditional Name: 1-[4-(4-benzoxy-N-isoamyl-anilino)piperidino]-2-(isoamylamino)-4-methyl-pentan-1-one Formula: C34H53N3O2 MolecularWeight: 535.80352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H53N3O2/c1-26(2)16-20-35-33(24-28(5)6)34(38)36-21-18-31(19-22-36)37(23-17-27(3)4)30-12-14-32(15-13-30)39-25-29-10-8-7-9-11-29/h7-15,26-28,31,33,35H,16-25H2,1-6H3