4-(1,5-dimethylpyrazol-4-yl)-2-methyl-N-(5-methylpyridin-1-ium-2-yl)-5-oxidanylidene-7-phenyl-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxamide

Systemtic Name: 4-(1,5-dimethylpyrazol-4-yl)-2-methyl-N-(5-methylpyridin-1-ium-2-yl)-5-oxidanylidene-7-phenyl-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxamide Openeye Name: 4-(1,5-dimethylpyrazol-4-yl)-2-methyl-N-(5-methylpyridin-1-ium-2-yl)-5-oxo-7-phenyl-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxamide CAS Name: 4-(1,5-dimethyl-4-pyrazolyl)-2-methyl-N-(5-methyl-2-pyridin-1-iumyl)-5-oxo-7-phenyl-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxamide IUPAC Name: 4-(1,5-dimethylpyrazol-4-yl)-2-methyl-N-(5-methylpyridin-1-ium-2-yl)-5-oxo-7-phenyl-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxamide Traditional Name: 4-(1,5-dimethylpyrazol-4-yl)-5-keto-2-methyl-N-(5-methylpyridin-1-ium-2-yl)-7-phenyl-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxamide Formula: C28H30N5O2+ MolecularWeight: 468.5701

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[NH+]=C(C=C1)NC(=O)C2=C(NC3=CC(CC(=O)C3C2C4=C(N(N=C4)C)C)C5=CC=CC=C5)C

Isomeric SMILES

CC1=C[NH+]=C(C=C1)NC(=O)C2=C(NC3=CC(CC(=O)C3C2C4=C(N(N=C4)C)C)C5=CC=CC=C5)C

InChI

InChI=1S/C28H29N5O2/c1-16-10-11-24(29-14-16)32-28(35)25-17(2)31-22-12-20(19-8-6-5-7-9-19)13-23(34)27(22)26(25)21-15-30-33(4)18(21)3/h5-12,14-15,20,26-27,31H,13H2,1-4H3,(H,29,32,35)/p+1