1-(3-cyanopropyl)indole-3-carboxylate

Systemtic Name: 1-(3-cyanopropyl)indole-3-carboxylate Openeye Name: 1-(3-cyanopropyl)indole-3-carboxylate CAS Name: 1-(3-cyanopropyl)-3-indolecarboxylate IUPAC Name: 1-(3-cyanopropyl)indole-3-carboxylate Traditional Name: 1-(3-cyanopropyl)indole-3-carboxylate Formula: C13H11N2O2- MolecularWeight: 227.23864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CCCC#N)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CCCC#N)C(=O)[O-]

InChI

InChI=1S/C13H12N2O2/c14-7-3-4-8-15-9-11(13(16)17)10-5-1-2-6-12(10)15/h1-2,5-6,9H,3-4,8H2,(H,16,17)/p-1