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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCC(CC1)N(CCC(C)C)C2=CC=C(C=C2)CCC3CCCCC3)N

Isomeric SMILES

CCC(C)C(C(=O)N1CCC(CC1)N(CCC(C)C)C2=CC=C(C=C2)CCC3CCCCC3)N

InChI

InChI=1S/C30H51N3O/c1-5-24(4)29(31)30(34)32-20-18-28(19-21-32)33(22-17-23(2)3)27-15-13-26(14-16-27)12-11-25-9-7-6-8-10-25/h13-16,23-25,28-29H,5-12,17-22,31H2,1-4H3