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

Systemtic Name: 7-chloranyl-1-(cyclohexylmethyl)-3-(4-methoxyphenyl)-3-methyl-5-piperazin-1-yl-quinoline-2,4-dione Openeye Name: 7-chloro-1-(cyclohexylmethyl)-3-(4-methoxyphenyl)-3-methyl-5-piperazin-1-yl-quinoline-2,4-dione CAS Name: 7-chloro-1-(cyclohexylmethyl)-3-(4-methoxyphenyl)-3-methyl-5-(1-piperazinyl)quinoline-2,4-dione IUPAC Name: 7-chloro-1-(cyclohexylmethyl)-3-(4-methoxyphenyl)-3-methyl-5-piperazin-1-ylquinoline-2,4-dione Traditional Name: 7-chloro-1-(cyclohexylmethyl)-3-(4-methoxyphenyl)-3-methyl-5-piperazino-quinoline-2,4-quinone Formula: C28H34ClN3O3 MolecularWeight: 496.04086

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C2=C(C=C(C=C2N(C1=O)CC3CCCCC3)Cl)N4CCNCC4)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1(C(=O)C2=C(C=C(C=C2N(C1=O)CC3CCCCC3)Cl)N4CCNCC4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C28H34ClN3O3/c1-28(20-8-10-22(35-2)11-9-20)26(33)25-23(31-14-12-30-13-15-31)16-21(29)17-24(25)32(27(28)34)18-19-6-4-3-5-7-19/h8-11,16-17,19,30H,3-7,12-15,18H2,1-2H3