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

Systemtic Name: 7-chloranyl-1-ethyl-3-(4-hydroxyphenyl)-3-methyl-5-piperazin-1-yl-quinoline-2,4-dione Openeye Name: 7-chloro-1-ethyl-3-(4-hydroxyphenyl)-3-methyl-5-piperazin-1-yl-quinoline-2,4-dione CAS Name: 7-chloro-1-ethyl-3-(4-hydroxyphenyl)-3-methyl-5-(1-piperazinyl)quinoline-2,4-dione IUPAC Name: 7-chloro-1-ethyl-3-(4-hydroxyphenyl)-3-methyl-5-piperazin-1-ylquinoline-2,4-dione Traditional Name: 7-chloro-1-ethyl-3-(4-hydroxyphenyl)-3-methyl-5-piperazino-quinoline-2,4-quinone Formula: C22H24ClN3O3 MolecularWeight: 413.89726

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC(=CC(=C2C(=O)C(C1=O)(C)C3=CC=C(C=C3)O)N4CCNCC4)Cl

Isomeric SMILES

CCN1C2=CC(=CC(=C2C(=O)C(C1=O)(C)C3=CC=C(C=C3)O)N4CCNCC4)Cl

InChI

InChI=1S/C22H24ClN3O3/c1-3-26-18-13-15(23)12-17(25-10-8-24-9-11-25)19(18)20(28)22(2,21(26)29)14-4-6-16(27)7-5-14/h4-7,12-13,24,27H,3,8-11H2,1-2H3