1-[4-(4-butylpiperazin-1-yl)-3-(3,3,5,5-tetramethylcyclohexyl)phenyl]-3-methoxy-propan-1-one hydrochloride

Systemtic Name: 1-[4-(4-butylpiperazin-1-yl)-3-(3,3,5,5-tetramethylcyclohexyl)phenyl]-3-methoxy-propan-1-one hydrochloride Openeye Name: 1-[4-(4-butylpiperazin-1-yl)-3-(3,3,5,5-tetramethylcyclohexyl)phenyl]-3-methoxy-propan-1-one hydrochloride CAS Name: 1-[4-(4-butyl-1-piperazinyl)-3-(3,3,5,5-tetramethylcyclohexyl)phenyl]-3-methoxy-1-propanone hydrochloride IUPAC Name: 1-[4-(4-butylpiperazin-1-yl)-3-(3,3,5,5-tetramethylcyclohexyl)phenyl]-3-methoxypropan-1-one hydrochloride Traditional Name: 1-[4-(4-butylpiperazino)-3-(3,3,5,5-tetramethylcyclohexyl)phenyl]-3-methoxy-propan-1-one hydrochloride Formula: C28H47ClN2O2 MolecularWeight: 479.13798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)CCOC)C3CC(CC(C3)(C)C)(C)C.Cl

Isomeric SMILES

CCCCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)CCOC)C3CC(CC(C3)(C)C)(C)C.Cl

InChI

InChI=1S/C28H46N2O2.ClH/c1-7-8-12-29-13-15-30(16-14-29)25-10-9-22(26(31)11-17-32-6)18-24(25)23-19-27(2,3)21-28(4,5)20-23;/h9-10,18,23H,7-8,11-17,19-21H2,1-6H3;1H