6-chloranyl-3-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-4-phenyl-1H-quinolin-2-one

Systemtic Name: 6-chloranyl-3-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-4-phenyl-1H-quinolin-2-one Openeye Name: 3-(4-benzhydrylpiperazin-4-ium-1-yl)-6-chloro-4-phenyl-1H-quinolin-2-one CAS Name: 6-chloro-3-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-4-phenyl-1H-quinolin-2-one IUPAC Name: 3-(4-benzhydrylpiperazin-4-ium-1-yl)-6-chloro-4-phenyl-1H-quinolin-2-one Traditional Name: 3-(4-benzhydrylpiperazin-4-ium-1-yl)-6-chloro-4-phenyl-carbostyril Formula: C32H29ClN3O+ MolecularWeight: 507.04516

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C4=C(C5=C(C=CC(=C5)Cl)NC4=O)C6=CC=CC=C6

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C4=C(C5=C(C=CC(=C5)Cl)NC4=O)C6=CC=CC=C6

InChI

InChI=1S/C32H28ClN3O/c33-26-16-17-28-27(22-26)29(23-10-4-1-5-11-23)31(32(37)34-28)36-20-18-35(19-21-36)30(24-12-6-2-7-13-24)25-14-8-3-9-15-25/h1-17,22,30H,18-21H2,(H,34,37)/p+1