7-chloranyl-2-(4-phenylbut-3-yn-2-yl)-3,5-dihydropyridazino[4,5-b]quinoline-1,4,10-trione

Systemtic Name: 7-chloranyl-2-(4-phenylbut-3-yn-2-yl)-3,5-dihydropyridazino[4,5-b]quinoline-1,4,10-trione Openeye Name: 7-chloro-2-(1-methyl-3-phenyl-prop-2-ynyl)-3,5-dihydropyridazino[4,5-b]quinoline-1,4,10-trione CAS Name: 7-chloro-2-(4-phenylbut-3-yn-2-yl)-3,5-dihydropyridazino[4,5-b]quinoline-1,4,10-trione IUPAC Name: 7-chloro-2-(4-phenylbut-3-yn-2-yl)-3,5-dihydropyridazino[4,5-b]quinoline-1,4,10-trione Traditional Name: 7-chloro-2-(1-methyl-3-phenyl-prop-2-ynyl)-3,5-dihydropyridazino[4,5-b]quinoline-1,4,10-trione Formula: C21H14ClN3O3 MolecularWeight: 391.80716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CC1=CC=CC=C1)N2C(=O)C3=C(C(=O)N2)NC4=C(C3=O)C=CC(=C4)Cl

Isomeric SMILES

CC(C#CC1=CC=CC=C1)N2C(=O)C3=C(C(=O)N2)NC4=C(C3=O)C=CC(=C4)Cl

InChI

InChI=1S/C21H14ClN3O3/c1-12(7-8-13-5-3-2-4-6-13)25-21(28)17-18(20(27)24-25)23-16-11-14(22)9-10-15(16)19(17)26/h2-6,9-12H,1H3,(H,23,26)(H,24,27)