(3,5-ditert-butylphenyl)-(4-methylpiperazin-1-yl)methanone hydrochloride

Systemtic Name: (3,5-ditert-butylphenyl)-(4-methylpiperazin-1-yl)methanone hydrochloride Openeye Name: (3,5-ditert-butylphenyl)-(4-methylpiperazin-1-yl)methanone hydrochloride CAS Name: (3,5-ditert-butylphenyl)-(4-methyl-1-piperazinyl)methanone hydrochloride IUPAC Name: (3,5-ditert-butylphenyl)-(4-methylpiperazin-1-yl)methanone hydrochloride Traditional Name: (3,5-ditert-butylphenyl)-(4-methylpiperazino)methanone hydrochloride Formula: C20H33ClN2O MolecularWeight: 352.94182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)C(=O)N2CCN(CC2)C)C(C)(C)C.Cl

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)C(=O)N2CCN(CC2)C)C(C)(C)C.Cl

InChI

InChI=1S/C20H32N2O.ClH/c1-19(2,3)16-12-15(13-17(14-16)20(4,5)6)18(23)22-10-8-21(7)9-11-22;/h12-14H,8-11H2,1-7H3;1H