(E)-(4-chlorophenyl)-(2-cyanoiminoisoquinolin-2-ium-1-ylidene)methanolate

Systemtic Name: (E)-(4-chlorophenyl)-(2-cyanoiminoisoquinolin-2-ium-1-ylidene)methanolate Openeye Name: (E)-(4-chlorophenyl)-(2-cyanoiminoisoquinolin-2-ium-1-ylidene)methanolate CAS Name: (E)-(4-chlorophenyl)-(2-cyanoimino-1-isoquinolin-2-iumylidene)methanolate IUPAC Name: (E)-(4-chlorophenyl)-(2-cyanoiminoisoquinolin-2-ium-1-ylidene)methanolate Traditional Name: (E)-(4-chlorophenyl)-(2-cyanoiminoisoquinolin-2-ium-1-ylidene)methanolate Formula: C17H10ClN3O MolecularWeight: 307.7338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C[N+](=NC#N)C2=C(C3=CC=C(C=C3)Cl)[O-]

Isomeric SMILES

C1=CC=C\2C(=C1)C=C[N+](=NC#N)/C2=C(\C3=CC=C(C=C3)Cl)/[O-]

InChI

InChI=1S/C17H10ClN3O/c18-14-7-5-13(6-8-14)17(22)16-15-4-2-1-3-12(15)9-10-21(16)20-11-19/h1-10H