7-chloranyl-2-(4-phenylpiperazin-1-yl)-3a,4,5,6-tetrahydro-1H-perimidine hydrochloride

Systemtic Name: 7-chloranyl-2-(4-phenylpiperazin-1-yl)-3a,4,5,6-tetrahydro-1H-perimidine hydrochloride Openeye Name: 7-chloro-2-(4-phenylpiperazin-1-yl)-3a,4,5,6-tetrahydro-1H-perimidine hydrochloride CAS Name: 7-chloro-2-(4-phenyl-1-piperazinyl)-3a,4,5,6-tetrahydro-1H-perimidine hydrochloride IUPAC Name: 7-chloro-2-(4-phenylpiperazin-1-yl)-3a,4,5,6-tetrahydro-1H-perimidine hydrochloride Traditional Name: 7-chloro-2-(4-phenylpiperazino)-3a,4,5,6-tetrahydro-1H-perimidine hydrochloride Formula: C21H24Cl2N4 MolecularWeight: 403.34806

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C3=C(C=CC(=C3C1)Cl)NC(=N2)N4CCN(CC4)C5=CC=CC=C5.Cl

Isomeric SMILES

C1CC2C3=C(C=CC(=C3C1)Cl)NC(=N2)N4CCN(CC4)C5=CC=CC=C5.Cl

InChI

InChI=1S/C21H23ClN4.ClH/c22-17-9-10-19-20-16(17)7-4-8-18(20)23-21(24-19)26-13-11-25(12-14-26)15-5-2-1-3-6-15;/h1-3,5-6,9-10,18H,4,7-8,11-14H2,(H,23,24);1H