1-butyl-4-[2-(4-tert-butylcyclohexen-1-yl)-4-(2,5-dimethylpyrrol-1-yl)phenyl]piperazine hydrochloride

Systemtic Name: 1-butyl-4-[2-(4-tert-butylcyclohexen-1-yl)-4-(2,5-dimethylpyrrol-1-yl)phenyl]piperazine hydrochloride Openeye Name: 1-butyl-4-[2-(4-tert-butylcyclohexen-1-yl)-4-(2,5-dimethylpyrrol-1-yl)phenyl]piperazine hydrochloride CAS Name: 1-butyl-4-[2-(4-tert-butyl-1-cyclohexenyl)-4-(2,5-dimethyl-1-pyrrolyl)phenyl]piperazine hydrochloride IUPAC Name: 1-butyl-4-[2-(4-tert-butylcyclohexen-1-yl)-4-(2,5-dimethylpyrrol-1-yl)phenyl]piperazine hydrochloride Traditional Name: 1-butyl-4-[2-(4-tert-butylcyclohexen-1-yl)-4-(2,5-dimethylpyrrol-1-yl)phenyl]piperazine hydrochloride Formula: C30H46ClN3 MolecularWeight: 484.15934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCN(CC1)C2=C(C=C(C=C2)N3C(=CC=C3C)C)C4=CCC(CC4)C(C)(C)C.Cl

Isomeric SMILES

CCCCN1CCN(CC1)C2=C(C=C(C=C2)N3C(=CC=C3C)C)C4=CCC(CC4)C(C)(C)C.Cl

InChI

InChI=1S/C30H45N3.ClH/c1-7-8-17-31-18-20-32(21-19-31)29-16-15-27(33-23(2)9-10-24(33)3)22-28(29)25-11-13-26(14-12-25)30(4,5)6;/h9-11,15-16,22,26H,7-8,12-14,17-21H2,1-6H3;1H