2-(4-chlorophenyl)-1-[3-[4-(diphenylmethyl)piperazin-1-ium-1-yl]propyl]indole

Systemtic Name: 2-(4-chlorophenyl)-1-[3-[4-(diphenylmethyl)piperazin-1-ium-1-yl]propyl]indole Openeye Name: 1-[3-(4-benzhydrylpiperazin-1-ium-1-yl)propyl]-2-(4-chlorophenyl)indole CAS Name: 2-(4-chlorophenyl)-1-[3-[4-(diphenylmethyl)-1-piperazin-1-iumyl]propyl]indole IUPAC Name: 1-[3-(4-benzhydrylpiperazin-1-ium-1-yl)propyl]-2-(4-chlorophenyl)indole Traditional Name: 1-[3-(4-benzhydrylpiperazin-1-ium-1-yl)propyl]-2-(4-chlorophenyl)indole Formula: C34H35ClN3+ MolecularWeight: 521.1148

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCN2C3=CC=CC=C3C=C2C4=CC=C(C=C4)Cl)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CC[NH+]1CCCN2C3=CC=CC=C3C=C2C4=CC=C(C=C4)Cl)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C34H34ClN3/c35-31-18-16-27(17-19-31)33-26-30-14-7-8-15-32(30)38(33)21-9-20-36-22-24-37(25-23-36)34(28-10-3-1-4-11-28)29-12-5-2-6-13-29/h1-8,10-19,26,34H,9,20-25H2/p+1