6-chloranyl-1-(cyanomethyl)indole-3-carboxylic acid

Systemtic Name: 6-chloranyl-1-(cyanomethyl)indole-3-carboxylic acid Openeye Name: 6-chloro-1-(cyanomethyl)indole-3-carboxylic acid CAS Name: 6-chloro-1-(cyanomethyl)-3-indolecarboxylic acid IUPAC Name: 6-chloro-1-(cyanomethyl)indole-3-carboxylic acid Traditional Name: 6-chloro-1-(cyanomethyl)indole-3-carboxylic acid Formula: C11H7ClN2O2 MolecularWeight: 234.63848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)N(C=C2C(=O)O)CC#N

Isomeric SMILES

C1=CC2=C(C=C1Cl)N(C=C2C(=O)O)CC#N

InChI

InChI=1S/C11H7ClN2O2/c12-7-1-2-8-9(11(15)16)6-14(4-3-13)10(8)5-7/h1-2,5-6H,4H2,(H,15,16)