2-(2,4-dichlorophenyl)-4-[4-(diphenylmethyl)piperazin-4-ium-1-yl]quinazoline

Systemtic Name: 2-(2,4-dichlorophenyl)-4-[4-(diphenylmethyl)piperazin-4-ium-1-yl]quinazoline Openeye Name: 4-(4-benzhydrylpiperazin-4-ium-1-yl)-2-(2,4-dichlorophenyl)quinazoline CAS Name: 2-(2,4-dichlorophenyl)-4-[4-(diphenylmethyl)-1-piperazin-4-iumyl]quinazoline IUPAC Name: 4-(4-benzhydrylpiperazin-4-ium-1-yl)-2-(2,4-dichlorophenyl)quinazoline Traditional Name: 4-(4-benzhydrylpiperazin-4-ium-1-yl)-2-(2,4-dichlorophenyl)quinazoline Formula: C31H27Cl2N4+ MolecularWeight: 526.47888

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C4=NC(=NC5=CC=CC=C54)C6=C(C=C(C=C6)Cl)Cl

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C4=NC(=NC5=CC=CC=C54)C6=C(C=C(C=C6)Cl)Cl

InChI

InChI=1S/C31H26Cl2N4/c32-24-15-16-25(27(33)21-24)30-34-28-14-8-7-13-26(28)31(35-30)37-19-17-36(18-20-37)29(22-9-3-1-4-10-22)23-11-5-2-6-12-23/h1-16,21,29H,17-20H2/p+1