2-[2-azanyl-4-(2-chloranyl-7-methyl-quinolin-3-yl)-6-(3-nitrophenyl)pyridin-3-yl]ethanenitrile

Systemtic Name: 2-[2-azanyl-4-(2-chloranyl-7-methyl-quinolin-3-yl)-6-(3-nitrophenyl)pyridin-3-yl]ethanenitrile Openeye Name: 2-[2-amino-4-(2-chloro-7-methyl-3-quinolyl)-6-(3-nitrophenyl)-3-pyridyl]acetonitrile CAS Name: 2-[2-amino-4-(2-chloro-7-methyl-3-quinolinyl)-6-(3-nitrophenyl)-3-pyridinyl]acetonitrile IUPAC Name: 2-[2-amino-4-(2-chloro-7-methylquinolin-3-yl)-6-(3-nitrophenyl)pyridin-3-yl]acetonitrile Traditional Name: 2-[2-amino-4-(2-chloro-7-methyl-3-quinolyl)-6-(3-nitrophenyl)-3-pyridyl]acetonitrile Formula: C23H16ClN5O2 MolecularWeight: 429.85844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)C3=CC(=NC(=C3CC#N)N)C4=CC(=CC=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)C3=CC(=NC(=C3CC#N)N)C4=CC(=CC=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C23H16ClN5O2/c1-13-5-6-15-11-19(22(24)27-20(15)9-13)18-12-21(28-23(26)17(18)7-8-25)14-3-2-4-16(10-14)29(30)31/h2-6,9-12H,7H2,1H3,(H2,26,28)