1-[2-oxidanylidene-2-(prop-2-ynylamino)ethyl]indole-4-carboxylic acid

Systemtic Name: 1-[2-oxidanylidene-2-(prop-2-ynylamino)ethyl]indole-4-carboxylic acid Openeye Name: 1-[2-oxo-2-(prop-2-ynylamino)ethyl]indole-4-carboxylic acid CAS Name: 1-[2-oxo-2-(prop-2-ynylamino)ethyl]-4-indolecarboxylic acid IUPAC Name: 1-[2-oxo-2-(prop-2-ynylamino)ethyl]indole-4-carboxylic acid Traditional Name: 1-[2-keto-2-(propargylamino)ethyl]indole-4-carboxylic acid Formula: C14H12N2O3 MolecularWeight: 256.25668

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)CN1C=CC2=C(C=CC=C21)C(=O)O

Isomeric SMILES

C#CCNC(=O)CN1C=CC2=C(C=CC=C21)C(=O)O

InChI

InChI=1S/C14H12N2O3/c1-2-7-15-13(17)9-16-8-6-10-11(14(18)19)4-3-5-12(10)16/h1,3-6,8H,7,9H2,(H,15,17)(H,18,19)