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

Systemtic Name: 2-azanyl-4-methyl-1-[4-[3-methylbutyl-(4-phenethylphenyl)amino]piperidin-1-yl]pentan-1-one Openeye Name: 2-amino-1-[4-(N-isopentyl-4-phenethyl-anilino)-1-piperidyl]-4-methyl-pentan-1-one CAS Name: 2-amino-4-methyl-1-[4-[N-(3-methylbutyl)-4-phenethylanilino]-1-piperidinyl]-1-pentanone IUPAC Name: 2-amino-4-methyl-1-[4-[N-(3-methylbutyl)-4-phenethylanilino]piperidin-1-yl]pentan-1-one Traditional Name: 2-amino-1-[4-(N-isoamyl-4-phenethyl-anilino)piperidino]-4-methyl-pentan-1-one Formula: C30H45N3O MolecularWeight: 463.6978

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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)CCC3=CC=CC=C3

Isomeric SMILES

CC(C)CCN(C1CCN(CC1)C(=O)C(CC(C)C)N)C2=CC=C(C=C2)CCC3=CC=CC=C3

InChI

InChI=1S/C30H45N3O/c1-23(2)16-21-33(28-17-19-32(20-18-28)30(34)29(31)22-24(3)4)27-14-12-26(13-15-27)11-10-25-8-6-5-7-9-25/h5-9,12-15,23-24,28-29H,10-11,16-22,31H2,1-4H3