2-[2,7-bis(chloranyl)-5,8-dimethoxy-4-(2-nitrophenyl)quinolin-6-yl]ethanenitrile

Systemtic Name: 2-[2,7-bis(chloranyl)-5,8-dimethoxy-4-(2-nitrophenyl)quinolin-6-yl]ethanenitrile Openeye Name: 2-[2,7-dichloro-5,8-dimethoxy-4-(2-nitrophenyl)-6-quinolyl]acetonitrile CAS Name: 2-[2,7-dichloro-5,8-dimethoxy-4-(2-nitrophenyl)-6-quinolinyl]acetonitrile IUPAC Name: 2-[2,7-dichloro-5,8-dimethoxy-4-(2-nitrophenyl)quinolin-6-yl]acetonitrile Traditional Name: 2-[2,7-dichloro-5,8-dimethoxy-4-(2-nitrophenyl)-6-quinolyl]acetonitrile Formula: C19H13Cl2N3O4 MolecularWeight: 418.23022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C2=C1C(=CC(=N2)Cl)C3=CC=CC=C3[N+](=O)[O-])OC)Cl)CC#N

Isomeric SMILES

COC1=C(C(=C(C2=C1C(=CC(=N2)Cl)C3=CC=CC=C3[N+](=O)[O-])OC)Cl)CC#N

InChI

InChI=1S/C19H13Cl2N3O4/c1-27-18-11(7-8-22)16(21)19(28-2)17-15(18)12(9-14(20)23-17)10-5-3-4-6-13(10)24(25)26/h3-6,9H,7H2,1-2H3