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

Systemtic Name: 7-chloranyl-3-(3-methoxyphenyl)-3-methyl-1-(phenylmethyl)-5-piperazin-1-yl-quinoline-2,4-dione Openeye Name: 1-benzyl-7-chloro-3-(3-methoxyphenyl)-3-methyl-5-piperazin-1-yl-quinoline-2,4-dione CAS Name: 7-chloro-3-(3-methoxyphenyl)-3-methyl-1-(phenylmethyl)-5-(1-piperazinyl)quinoline-2,4-dione IUPAC Name: 1-benzyl-7-chloro-3-(3-methoxyphenyl)-3-methyl-5-piperazin-1-ylquinoline-2,4-dione Traditional Name: 1-benzyl-7-chloro-3-(3-methoxyphenyl)-3-methyl-5-piperazino-quinoline-2,4-quinone Formula: C28H28ClN3O3 MolecularWeight: 489.99322

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C28H28ClN3O3/c1-28(20-9-6-10-22(15-20)35-2)26(33)25-23(31-13-11-30-12-14-31)16-21(29)17-24(25)32(27(28)34)18-19-7-4-3-5-8-19/h3-10,15-17,30H,11-14,18H2,1-2H3