4-[(3R)-5-(6-chloranyl-2-oxidanylidene-4-phenyl-1H-quinolin-3-yl)-3-(4-dimethylaminophenyl)-1,3-dihydropyrazol-2-yl]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(3R)-5-(6-chloranyl-2-oxidanylidene-4-phenyl-1H-quinolin-3-yl)-3-(4-dimethylaminophenyl)-1,3-dihydropyrazol-2-yl]-4-oxidanylidene-butanoate Openeye Name: 4-[(3R)-5-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)-3-(4-dimethylaminophenyl)-1,3-dihydropyrazol-2-yl]-4-oxo-butanoate CAS Name: 4-[(3R)-5-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)-3-(4-dimethylaminophenyl)-1,3-dihydropyrazol-2-yl]-4-oxobutanoate IUPAC Name: 4-[(3R)-5-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)-3-(4-dimethylaminophenyl)-1,3-dihydropyrazol-2-yl]-4-oxobutanoate Traditional Name: 4-[(5R)-3-(6-chloro-2-keto-4-phenyl-1H-quinolin-3-yl)-5-(4-dimethylaminophenyl)-3-pyrazolin-1-yl]-4-keto-butyrate Formula: C30H26ClN4O4- MolecularWeight: 542.00484

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2C=C(NN2C(=O)CCC(=O)[O-])C3=C(C4=C(C=CC(=C4)Cl)NC3=O)C5=CC=CC=C5

Isomeric SMILES

CN(C)C1=CC=C(C=C1)[C@H]2C=C(NN2C(=O)CCC(=O)[O-])C3=C(C4=C(C=CC(=C4)Cl)NC3=O)C5=CC=CC=C5

InChI

InChI=1S/C30H27ClN4O4/c1-34(2)21-11-8-18(9-12-21)25-17-24(33-35(25)26(36)14-15-27(37)38)29-28(19-6-4-3-5-7-19)22-16-20(31)10-13-23(22)32-30(29)39/h3-13,16-17,25,33H,14-15H2,1-2H3,(H,32,39)(H,37,38)/p-1/t25-/m1/s1