2,2-dimethyl-4-[4-(3-nitrophenyl)-2-oxidanylidene-1H-pyridin-3-yl]-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 2,2-dimethyl-4-[4-(3-nitrophenyl)-2-oxidanylidene-1H-pyridin-3-yl]-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: 3-hydroxy-2,2-dimethyl-4-[4-(3-nitrophenyl)-2-oxo-1H-pyridin-3-yl]chromane-6-carbonitrile CAS Name: 3-hydroxy-2,2-dimethyl-4-[4-(3-nitrophenyl)-2-oxo-1H-pyridin-3-yl]-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 3-hydroxy-2,2-dimethyl-4-[4-(3-nitrophenyl)-2-oxo-1H-pyridin-3-yl]-3,4-dihydrochromene-6-carbonitrile Traditional Name: 3-hydroxy-4-[2-keto-4-(3-nitrophenyl)-1H-pyridin-3-yl]-2,2-dimethyl-chroman-6-carbonitrile Formula: C23H19N3O5 MolecularWeight: 417.41406

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)C3=C(C=CNC3=O)C4=CC(=CC=C4)[N+](=O)[O-])O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)C3=C(C=CNC3=O)C4=CC(=CC=C4)[N+](=O)[O-])O)C

InChI

InChI=1S/C23H19N3O5/c1-23(2)21(27)19(17-10-13(12-24)6-7-18(17)31-23)20-16(8-9-25-22(20)28)14-4-3-5-15(11-14)26(29)30/h3-11,19,21,27H,1-2H3,(H,25,28)