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

Systemtic Name: 2-azanyl-4-methyl-1-[4-[3-methylbutyl-(4-phenylmethoxyphenyl)amino]piperidin-1-yl]pentan-1-one Openeye Name: 2-amino-1-[4-(4-benzyloxy-N-isopentyl-anilino)-1-piperidyl]-4-methyl-pentan-1-one CAS Name: 2-amino-4-methyl-1-[4-[N-(3-methylbutyl)-4-phenylmethoxyanilino]-1-piperidinyl]-1-pentanone IUPAC Name: 2-amino-4-methyl-1-[4-[N-(3-methylbutyl)-4-phenylmethoxyanilino]piperidin-1-yl]pentan-1-one Traditional Name: 2-amino-1-[4-(4-benzoxy-N-isoamyl-anilino)piperidino]-4-methyl-pentan-1-one Formula: C29H43N3O2 MolecularWeight: 465.67062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(C1CCN(CC1)C(=O)C(CC(C)C)N)C2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)CCN(C1CCN(CC1)C(=O)C(CC(C)C)N)C2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C29H43N3O2/c1-22(2)14-19-32(26-15-17-31(18-16-26)29(33)28(30)20-23(3)4)25-10-12-27(13-11-25)34-21-24-8-6-5-7-9-24/h5-13,22-23,26,28H,14-21,30H2,1-4H3