2-[[(E)-3-(1H-indol-3-yl)prop-2-enoyl]amino]ethanoic acid

Systemtic Name: 2-[[(E)-3-(1H-indol-3-yl)prop-2-enoyl]amino]ethanoic acid Openeye Name: 2-[[(E)-3-(1H-indol-3-yl)prop-2-enoyl]amino]acetic acid CAS Name: 2-[[(E)-3-(1H-indol-3-yl)-1-oxoprop-2-enyl]amino]acetic acid IUPAC Name: 2-[[(E)-3-(1H-indol-3-yl)prop-2-enoyl]amino]acetic acid Traditional Name: 2-[[(E)-3-(1H-indol-3-yl)acryloyl]amino]acetic acid Formula: C13H12N2O3 MolecularWeight: 244.24598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)C=CC(=O)NCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)/C=C/C(=O)NCC(=O)O

InChI

InChI=1S/C13H12N2O3/c16-12(15-8-13(17)18)6-5-9-7-14-11-4-2-1-3-10(9)11/h1-7,14H,8H2,(H,15,16)(H,17,18)/b6-5+