2-azanyl-4-(2,4-dichlorophenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-azanyl-4-(2,4-dichlorophenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-1-ium-3-carbonitrile Openeye Name: 2-amino-4-(2,4-dichlorophenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-1-ium-3-carbonitrile CAS Name: 2-amino-4-(2,4-dichlorophenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-1-ium-3-carbonitrile IUPAC Name: 2-amino-4-(2,4-dichlorophenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-1-ium-3-carbonitrile Traditional Name: 2-amino-4-(2,4-dichlorophenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-1-ium-3-carbonitrile Formula: C17H16Cl2N3+ MolecularWeight: 333.23504

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)[NH+]=C(C(=C2C3=C(C=C(C=C3)Cl)Cl)C#N)N

Isomeric SMILES

C1CCC2=C(CC1)[NH+]=C(C(=C2C3=C(C=C(C=C3)Cl)Cl)C#N)N

InChI

InChI=1S/C17H15Cl2N3/c18-10-6-7-11(14(19)8-10)16-12-4-2-1-3-5-15(12)22-17(21)13(16)9-20/h6-8H,1-5H2,(H2,21,22)/p+1