2-azanyl-4-(2,4-dichlorophenyl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile

Systemtic Name: 2-azanyl-4-(2,4-dichlorophenyl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile Openeye Name: 2-amino-4-(2,4-dichlorophenyl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile CAS Name: 2-amino-4-(2,4-dichlorophenyl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile IUPAC Name: 2-amino-4-(2,4-dichlorophenyl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile Traditional Name: 2-amino-4-(2,4-dichlorophenyl)-5,6,7,8-tetrahydroquinolin-1-ium-3-carbonitrile Formula: C16H14Cl2N3+ MolecularWeight: 319.20846

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(C(=[NH+]2)N)C#N)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1CCC2=C(C1)C(=C(C(=[NH+]2)N)C#N)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H13Cl2N3/c17-9-5-6-10(13(18)7-9)15-11-3-1-2-4-14(11)21-16(20)12(15)8-19/h5-7H,1-4H2,(H2,20,21)/p+1