3-[2-(3-chloranyl-4-methyl-phenyl)-1,2,4-triazol-3-yl]-7,7-dimethyl-1-phenyl-6,8-dihydroquinoline-2,5-dione

Systemtic Name: 3-[2-(3-chloranyl-4-methyl-phenyl)-1,2,4-triazol-3-yl]-7,7-dimethyl-1-phenyl-6,8-dihydroquinoline-2,5-dione Openeye Name: 3-[2-(3-chloro-4-methyl-phenyl)-1,2,4-triazol-3-yl]-7,7-dimethyl-1-phenyl-6,8-dihydroquinoline-2,5-dione CAS Name: 3-[2-(3-chloro-4-methylphenyl)-1,2,4-triazol-3-yl]-7,7-dimethyl-1-phenyl-6,8-dihydroquinoline-2,5-dione IUPAC Name: 3-[2-(3-chloro-4-methylphenyl)-1,2,4-triazol-3-yl]-7,7-dimethyl-1-phenyl-6,8-dihydroquinoline-2,5-dione Traditional Name: 3-[2-(3-chloro-4-methyl-phenyl)-1,2,4-triazol-3-yl]-7,7-dimethyl-1-phenyl-6,8-dihydroquinoline-2,5-quinone Formula: C26H23ClN4O2 MolecularWeight: 458.93942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=NC=N2)C3=CC4=C(CC(CC4=O)(C)C)N(C3=O)C5=CC=CC=C5)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=NC=N2)C3=CC4=C(CC(CC4=O)(C)C)N(C3=O)C5=CC=CC=C5)Cl

InChI

InChI=1S/C26H23ClN4O2/c1-16-9-10-18(11-21(16)27)31-24(28-15-29-31)20-12-19-22(13-26(2,3)14-23(19)32)30(25(20)33)17-7-5-4-6-8-17/h4-12,15H,13-14H2,1-3H3