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

Systemtic Name: 7-chloranyl-3-methyl-5-(4-methylpiperazin-1-yl)-3-phenyl-1-(phenylmethyl)quinoline-2,4-dione Openeye Name: 1-benzyl-7-chloro-3-methyl-5-(4-methylpiperazin-1-yl)-3-phenyl-quinoline-2,4-dione CAS Name: 7-chloro-3-methyl-5-(4-methyl-1-piperazinyl)-3-phenyl-1-(phenylmethyl)quinoline-2,4-dione IUPAC Name: 1-benzyl-7-chloro-3-methyl-5-(4-methylpiperazin-1-yl)-3-phenylquinoline-2,4-dione Traditional Name: 1-benzyl-7-chloro-3-methyl-5-(4-methylpiperazino)-3-phenyl-quinoline-2,4-quinone Formula: C28H28ClN3O2 MolecularWeight: 473.99382

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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)N4CCN(CC4)C)C5=CC=CC=C5

Isomeric SMILES

CC1(C(=O)C2=C(C=C(C=C2N(C1=O)CC3=CC=CC=C3)Cl)N4CCN(CC4)C)C5=CC=CC=C5

InChI

InChI=1S/C28H28ClN3O2/c1-28(21-11-7-4-8-12-21)26(33)25-23(31-15-13-30(2)14-16-31)17-22(29)18-24(25)32(27(28)34)19-20-9-5-3-6-10-20/h3-12,17-18H,13-16,19H2,1-2H3