2-azanyl-1-(3-nitrophenyl)-5-oxidanylidene-4-pyridin-3-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-1-(3-nitrophenyl)-5-oxidanylidene-4-pyridin-3-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-1-(3-nitrophenyl)-5-oxo-4-(3-pyridyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-1-(3-nitrophenyl)-5-oxo-4-(3-pyridinyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-1-(3-nitrophenyl)-5-oxo-4-pyridin-3-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-5-keto-1-(3-nitrophenyl)-4-(3-pyridyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C21H17N5O3 MolecularWeight: 387.39138

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C(=C(N2C3=CC(=CC=C3)[N+](=O)[O-])N)C#N)C4=CN=CC=C4)C(=O)C1

Isomeric SMILES

C1CC2=C(C(C(=C(N2C3=CC(=CC=C3)[N+](=O)[O-])N)C#N)C4=CN=CC=C4)C(=O)C1

InChI

InChI=1S/C21H17N5O3/c22-11-16-19(13-4-3-9-24-12-13)20-17(7-2-8-18(20)27)25(21(16)23)14-5-1-6-15(10-14)26(28)29/h1,3-6,9-10,12,19H,2,7-8,23H2