2-(2-iodanylphenyl)carbonyl-1H-isoquinoline-1-carbonitrile

Systemtic Name: 2-(2-iodanylphenyl)carbonyl-1H-isoquinoline-1-carbonitrile Openeye Name: 2-(2-iodobenzoyl)-1H-isoquinoline-1-carbonitrile CAS Name: 2-[(2-iodophenyl)-oxomethyl]-1H-isoquinoline-1-carbonitrile IUPAC Name: 2-(2-iodobenzoyl)-1H-isoquinoline-1-carbonitrile Traditional Name: 2-(2-iodobenzoyl)-1H-isoquinoline-1-carbonitrile Formula: C17H11IN2O MolecularWeight: 386.18651

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(N(C=CC2=C1)C(=O)C3=CC=CC=C3I)C#N

Isomeric SMILES

C1=CC=C2C(N(C=CC2=C1)C(=O)C3=CC=CC=C3I)C#N

InChI

InChI=1S/C17H11IN2O/c18-15-8-4-3-7-14(15)17(21)20-10-9-12-5-1-2-6-13(12)16(20)11-19/h1-10,16H