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

Systemtic Name: 1-[(3-aminophenyl)methyl]-7-chloranyl-3-(4-methoxyphenyl)-3-methyl-5-piperazin-1-yl-quinoline-2,4-dione Openeye Name: 1-[(3-aminophenyl)methyl]-7-chloro-3-(4-methoxyphenyl)-3-methyl-5-piperazin-1-yl-quinoline-2,4-dione CAS Name: 1-[(3-aminophenyl)methyl]-7-chloro-3-(4-methoxyphenyl)-3-methyl-5-(1-piperazinyl)quinoline-2,4-dione IUPAC Name: 1-[(3-aminophenyl)methyl]-7-chloro-3-(4-methoxyphenyl)-3-methyl-5-piperazin-1-ylquinoline-2,4-dione Traditional Name: 1-(3-aminobenzyl)-7-chloro-3-(4-methoxyphenyl)-3-methyl-5-piperazino-quinoline-2,4-quinone Formula: C28H29ClN4O3 MolecularWeight: 505.00786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H29ClN4O3/c1-28(19-6-8-22(36-2)9-7-19)26(34)25-23(32-12-10-31-11-13-32)15-20(29)16-24(25)33(27(28)35)17-18-4-3-5-21(30)14-18/h3-9,14-16,31H,10-13,17,30H2,1-2H3