1-(cyanomethyl)indole-3-carboxylic acid

Systemtic Name: 1-(cyanomethyl)indole-3-carboxylic acid Openeye Name: 1-(cyanomethyl)indole-3-carboxylic acid CAS Name: 1-(cyanomethyl)-3-indolecarboxylic acid IUPAC Name: 1-(cyanomethyl)indole-3-carboxylic acid Traditional Name: 1-(cyanomethyl)indole-3-carboxylic acid Formula: C11H8N2O2 MolecularWeight: 200.19342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CC#N)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CC#N)C(=O)O

InChI

InChI=1S/C11H8N2O2/c12-5-6-13-7-9(11(14)15)8-3-1-2-4-10(8)13/h1-4,7H,6H2,(H,14,15)