2-(2-chlorophenyl)-4-[[4-(diphenylmethyl)piperazin-1-yl]methylidene]isoquinoline-1,3-dione

Systemtic Name: 2-(2-chlorophenyl)-4-[[4-(diphenylmethyl)piperazin-1-yl]methylidene]isoquinoline-1,3-dione Openeye Name: 4-[(4-benzhydrylpiperazin-1-yl)methylene]-2-(2-chlorophenyl)isoquinoline-1,3-dione CAS Name: 2-(2-chlorophenyl)-4-[[4-(diphenylmethyl)-1-piperazinyl]methylidene]isoquinoline-1,3-dione IUPAC Name: 4-[(4-benzhydrylpiperazin-1-yl)methylidene]-2-(2-chlorophenyl)isoquinoline-1,3-dione Traditional Name: 4-[(4-benzhydrylpiperazino)methylene]-2-(2-chlorophenyl)isoquinoline-1,3-quinone Formula: C33H28ClN3O2 MolecularWeight: 534.04732

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=C2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=C4Cl)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1C=C2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=C4Cl)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C33H28ClN3O2/c34-29-17-9-10-18-30(29)37-32(38)27-16-8-7-15-26(27)28(33(37)39)23-35-19-21-36(22-20-35)31(24-11-3-1-4-12-24)25-13-5-2-6-14-25/h1-18,23,31H,19-22H2