2-cyano-3-phenyl-indole-2-carboxylic acid

Systemtic Name: 2-cyano-3-phenyl-indole-2-carboxylic acid Openeye Name: 2-cyano-3-phenyl-indole-2-carboxylic acid CAS Name: 2-cyano-3-phenyl-2-indolecarboxylic acid IUPAC Name: 2-cyano-3-phenylindole-2-carboxylic acid Traditional Name: 2-cyano-3-phenyl-indole-2-carboxylic acid Formula: C16H10N2O2 MolecularWeight: 262.2628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC=CC3=NC2(C#N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC=CC3=NC2(C#N)C(=O)O

InChI

InChI=1S/C16H10N2O2/c17-10-16(15(19)20)14(11-6-2-1-3-7-11)12-8-4-5-9-13(12)18-16/h1-9H,(H,19,20)