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

Systemtic Name: 4-methyl-1-[4-[3-methylbut-2-enyl-(4-phenylmethoxyphenyl)amino]piperidin-1-yl]-2-(3-methylbutylamino)pentan-1-one Openeye Name: 1-[4-[4-benzyloxy-N-(3-methylbut-2-enyl)anilino]-1-piperidyl]-2-(isopentylamino)-4-methyl-pentan-1-one CAS Name: 4-methyl-1-[4-[N-(3-methylbut-2-enyl)-4-phenylmethoxyanilino]-1-piperidinyl]-2-(3-methylbutylamino)-1-pentanone IUPAC Name: 4-methyl-1-[4-[N-(3-methylbut-2-enyl)-4-phenylmethoxyanilino]piperidin-1-yl]-2-(3-methylbutylamino)pentan-1-one Traditional Name: 1-[4-[4-benzoxy-N-(3-methylbut-2-enyl)anilino]piperidino]-2-(isoamylamino)-4-methyl-pentan-1-one Formula: C34H51N3O2 MolecularWeight: 533.78764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H51N3O2/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/h7-15,17,26,28,31,33,35H,16,18-25H2,1-6H3