4-(3-aminophenyl)-2-azanyl-6-(2-chloranyl-8-methyl-quinolin-3-yl)pyridin-1-ium-3-carbonitrile

Systemtic Name: 4-(3-aminophenyl)-2-azanyl-6-(2-chloranyl-8-methyl-quinolin-3-yl)pyridin-1-ium-3-carbonitrile Openeye Name: 2-amino-4-(3-aminophenyl)-6-(2-chloro-8-methyl-3-quinolyl)pyridin-1-ium-3-carbonitrile CAS Name: 2-amino-4-(3-aminophenyl)-6-(2-chloro-8-methyl-3-quinolinyl)-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-amino-4-(3-aminophenyl)-6-(2-chloro-8-methylquinolin-3-yl)pyridin-1-ium-3-carbonitrile Traditional Name: 2-amino-4-(3-aminophenyl)-6-(2-chloro-8-methyl-3-quinolyl)pyridin-1-ium-3-carbonitrile Formula: C22H17ClN5+ MolecularWeight: 386.85688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=CC(=C(N=C12)Cl)C3=[NH+]C(=C(C(=C3)C4=CC(=CC=C4)N)C#N)N

Isomeric SMILES

CC1=CC=CC2=CC(=C(N=C12)Cl)C3=[NH+]C(=C(C(=C3)C4=CC(=CC=C4)N)C#N)N

InChI

InChI=1S/C22H16ClN5/c1-12-4-2-6-14-9-17(21(23)28-20(12)14)19-10-16(18(11-24)22(26)27-19)13-5-3-7-15(25)8-13/h2-10H,25H2,1H3,(H2,26,27)/p+1