4-[(3S)-3-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-5-phenyl-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(3S)-3-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-5-phenyl-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoate Openeye Name: 4-[(3S)-3-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-5-phenyl-3,4-dihydropyrazol-2-yl]-4-oxo-butanoate CAS Name: 4-[(3S)-3-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-5-phenyl-3,4-dihydropyrazol-2-yl]-4-oxobutanoate IUPAC Name: 4-[(3S)-3-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-5-phenyl-3,4-dihydropyrazol-2-yl]-4-oxobutanoate Traditional Name: 4-keto-4-[(5S)-5-[(2-keto-6-methyl-1H-quinolin-3-yl)methyl]-3-phenyl-2-pyrazolin-1-yl]butyrate Formula: C24H22N3O4- MolecularWeight: 416.44918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)C(=C2)CC3CC(=NN3C(=O)CCC(=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)C(=C2)C[C@H]3CC(=NN3C(=O)CCC(=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C24H23N3O4/c1-15-7-8-20-17(11-15)12-18(24(31)25-20)13-19-14-21(16-5-3-2-4-6-16)26-27(19)22(28)9-10-23(29)30/h2-8,11-12,19H,9-10,13-14H2,1H3,(H,25,31)(H,29,30)/p-1/t19-/m0/s1