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

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

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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)N)Cl)N4CCN(CC4)C)C5=CC=C(C=C5)O

Isomeric SMILES

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

InChI

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