5-[4-[[4-(cyclohexylmethylamino)phenyl]-(3-methylbutyl)amino]piperidin-1-yl]-2-methyl-5-oxidanylidene-pentanamide

Systemtic Name: 5-[4-[[4-(cyclohexylmethylamino)phenyl]-(3-methylbutyl)amino]piperidin-1-yl]-2-methyl-5-oxidanylidene-pentanamide Openeye Name: 5-[4-[4-(cyclohexylmethylamino)-N-isopentyl-anilino]-1-piperidyl]-2-methyl-5-oxo-pentanamide CAS Name: 5-[4-[4-(cyclohexylmethylamino)-N-(3-methylbutyl)anilino]-1-piperidinyl]-2-methyl-5-oxopentanamide IUPAC Name: 5-[4-[4-(cyclohexylmethylamino)-N-(3-methylbutyl)anilino]piperidin-1-yl]-2-methyl-5-oxopentanamide Traditional Name: 5-[4-[4-(cyclohexylmethylamino)-N-isoamyl-anilino]piperidino]-5-keto-2-methyl-valeramide Formula: C29H48N4O2 MolecularWeight: 484.71702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(C1CCN(CC1)C(=O)CCC(C)C(=O)N)C2=CC=C(C=C2)NCC3CCCCC3

Isomeric SMILES

CC(C)CCN(C1CCN(CC1)C(=O)CCC(C)C(=O)N)C2=CC=C(C=C2)NCC3CCCCC3

InChI

InChI=1S/C29H48N4O2/c1-22(2)15-20-33(26-12-10-25(11-13-26)31-21-24-7-5-4-6-8-24)27-16-18-32(19-17-27)28(34)14-9-23(3)29(30)35/h10-13,22-24,27,31H,4-9,14-21H2,1-3H3,(H2,30,35)