1-(4-chlorophenyl)-4-(4-cycloheptylpiperazin-1-yl)butane-1,4-dione hydrochloride

Systemtic Name: 1-(4-chlorophenyl)-4-(4-cycloheptylpiperazin-1-yl)butane-1,4-dione hydrochloride Openeye Name: 1-(4-chlorophenyl)-4-(4-cycloheptylpiperazin-1-yl)butane-1,4-dione hydrochloride CAS Name: 1-(4-chlorophenyl)-4-(4-cycloheptyl-1-piperazinyl)butane-1,4-dione hydrochloride IUPAC Name: 1-(4-chlorophenyl)-4-(4-cycloheptylpiperazin-1-yl)butane-1,4-dione hydrochloride Traditional Name: 1-(4-chlorophenyl)-4-(4-cycloheptylpiperazino)butane-1,4-dione hydrochloride Formula: C21H30Cl2N2O2 MolecularWeight: 413.3811

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)N2CCN(CC2)C(=O)CCC(=O)C3=CC=C(C=C3)Cl.Cl

Isomeric SMILES

C1CCCC(CC1)N2CCN(CC2)C(=O)CCC(=O)C3=CC=C(C=C3)Cl.Cl

InChI

InChI=1S/C21H29ClN2O2.ClH/c22-18-9-7-17(8-10-18)20(25)11-12-21(26)24-15-13-23(14-16-24)19-5-3-1-2-4-6-19;/h7-10,19H,1-6,11-16H2;1H