2-azanyl-7-(4-fluorophenyl)-4-(3-nitrophenyl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile

Systemtic Name: 2-azanyl-7-(4-fluorophenyl)-4-(3-nitrophenyl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: 2-amino-7-(4-fluorophenyl)-4-(3-nitrophenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: 2-amino-7-(4-fluorophenyl)-4-(3-nitrophenyl)-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-7-(4-fluorophenyl)-4-(3-nitrophenyl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: 2-amino-7-(4-fluorophenyl)-5-keto-4-(3-nitrophenyl)-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C22H16FN3O4 MolecularWeight: 405.378543

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(=O)C2=C1OC(=C(C2C3=CC(=CC=C3)[N+](=O)[O-])C#N)N)C4=CC=C(C=C4)F

Isomeric SMILES

C1C(CC(=O)C2=C1OC(=C(C2C3=CC(=CC=C3)[N+](=O)[O-])C#N)N)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H16FN3O4/c23-15-6-4-12(5-7-15)14-9-18(27)21-19(10-14)30-22(25)17(11-24)20(21)13-2-1-3-16(8-13)26(28)29/h1-8,14,20H,9-10,25H2