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

Systemtic Name: 2-azanyl-1-[3-[[4-(2-cyclohexylethyl)phenyl]-(3-methylbutyl)amino]piperidin-1-yl]-4-methyl-pentan-1-one Openeye Name: 2-amino-1-[3-[4-(2-cyclohexylethyl)-N-isopentyl-anilino]-1-piperidyl]-4-methyl-pentan-1-one CAS Name: 2-amino-1-[3-[4-(2-cyclohexylethyl)-N-(3-methylbutyl)anilino]-1-piperidinyl]-4-methyl-1-pentanone IUPAC Name: 2-amino-1-[3-[4-(2-cyclohexylethyl)-N-(3-methylbutyl)anilino]piperidin-1-yl]-4-methylpentan-1-one Traditional Name: 2-amino-1-[3-[4-(2-cyclohexylethyl)-N-isoamyl-anilino]piperidino]-4-methyl-pentan-1-one Formula: C30H51N3O MolecularWeight: 469.74544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(C1CCCN(C1)C(=O)C(CC(C)C)N)C2=CC=C(C=C2)CCC3CCCCC3

Isomeric SMILES

CC(C)CCN(C1CCCN(C1)C(=O)C(CC(C)C)N)C2=CC=C(C=C2)CCC3CCCCC3

InChI

InChI=1S/C30H51N3O/c1-23(2)18-20-33(28-11-8-19-32(22-28)30(34)29(31)21-24(3)4)27-16-14-26(15-17-27)13-12-25-9-6-5-7-10-25/h14-17,23-25,28-29H,5-13,18-22,31H2,1-4H3