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

Systemtic Name: 1-[(2-bromophenyl)methyl]-7-chloranyl-3-(4-methoxyphenyl)-3-methyl-5-piperazin-1-yl-quinoline-2,4-dione Openeye Name: 1-[(2-bromophenyl)methyl]-7-chloro-3-(4-methoxyphenyl)-3-methyl-5-piperazin-1-yl-quinoline-2,4-dione CAS Name: 1-[(2-bromophenyl)methyl]-7-chloro-3-(4-methoxyphenyl)-3-methyl-5-(1-piperazinyl)quinoline-2,4-dione IUPAC Name: 1-[(2-bromophenyl)methyl]-7-chloro-3-(4-methoxyphenyl)-3-methyl-5-piperazin-1-ylquinoline-2,4-dione Traditional Name: 1-(2-bromobenzyl)-7-chloro-3-(4-methoxyphenyl)-3-methyl-5-piperazino-quinoline-2,4-quinone Formula: C28H27BrClN3O3 MolecularWeight: 568.88928

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C2=C(C=C(C=C2N(C1=O)CC3=CC=CC=C3Br)Cl)N4CCNCC4)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1(C(=O)C2=C(C=C(C=C2N(C1=O)CC3=CC=CC=C3Br)Cl)N4CCNCC4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C28H27BrClN3O3/c1-28(19-7-9-21(36-2)10-8-19)26(34)25-23(32-13-11-31-12-14-32)15-20(30)16-24(25)33(27(28)35)17-18-5-3-4-6-22(18)29/h3-10,15-16,31H,11-14,17H2,1-2H3