7,9-bis(chloranyl)-2-(4-phenylpiperazin-1-yl)-3a,4,5,6-tetrahydro-1H-perimidine

Systemtic Name: 7,9-bis(chloranyl)-2-(4-phenylpiperazin-1-yl)-3a,4,5,6-tetrahydro-1H-perimidine Openeye Name: 7,9-dichloro-2-(4-phenylpiperazin-1-yl)-3a,4,5,6-tetrahydro-1H-perimidine CAS Name: 7,9-dichloro-2-(4-phenyl-1-piperazinyl)-3a,4,5,6-tetrahydro-1H-perimidine IUPAC Name: 7,9-dichloro-2-(4-phenylpiperazin-1-yl)-3a,4,5,6-tetrahydro-1H-perimidine Traditional Name: 7,9-dichloro-2-(4-phenylpiperazino)-3a,4,5,6-tetrahydro-1H-perimidine Formula: C21H22Cl2N4 MolecularWeight: 401.33218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2C3=C(C1)C(=CC(=C3NC(=N2)N4CCN(CC4)C5=CC=CC=C5)Cl)Cl

Isomeric SMILES

C1CC2C3=C(C1)C(=CC(=C3NC(=N2)N4CCN(CC4)C5=CC=CC=C5)Cl)Cl

InChI

InChI=1S/C21H22Cl2N4/c22-16-13-17(23)20-19-15(16)7-4-8-18(19)24-21(25-20)27-11-9-26(10-12-27)14-5-2-1-3-6-14/h1-3,5-6,13,18H,4,7-12H2,(H,24,25)