7-chloranyl-3-methyl-3-phenyl-1-(phenylmethyl)-5-piperazin-1-yl-quinoline-2,4-dione

Systemtic Name: 7-chloranyl-3-methyl-3-phenyl-1-(phenylmethyl)-5-piperazin-1-yl-quinoline-2,4-dione Openeye Name: 1-benzyl-7-chloro-3-methyl-3-phenyl-5-piperazin-1-yl-quinoline-2,4-dione CAS Name: 7-chloro-3-methyl-3-phenyl-1-(phenylmethyl)-5-(1-piperazinyl)quinoline-2,4-dione IUPAC Name: 1-benzyl-7-chloro-3-methyl-3-phenyl-5-piperazin-1-ylquinoline-2,4-dione Traditional Name: 1-benzyl-7-chloro-3-methyl-3-phenyl-5-piperazino-quinoline-2,4-quinone Formula: C27H26ClN3O2 MolecularWeight: 459.96724

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C2=C(C=C(C=C2N(C1=O)CC3=CC=CC=C3)Cl)N4CCNCC4)C5=CC=CC=C5

Isomeric SMILES

CC1(C(=O)C2=C(C=C(C=C2N(C1=O)CC3=CC=CC=C3)Cl)N4CCNCC4)C5=CC=CC=C5

InChI

InChI=1S/C27H26ClN3O2/c1-27(20-10-6-3-7-11-20)25(32)24-22(30-14-12-29-13-15-30)16-21(28)17-23(24)31(26(27)33)18-19-8-4-2-5-9-19/h2-11,16-17,29H,12-15,18H2,1H3