3-(2-azanylethyl)-1H-indole-2-carboxylic acid; ethanoic acid

Systemtic Name: 3-(2-azanylethyl)-1H-indole-2-carboxylic acid; ethanoic acid Openeye Name: acetic acid; 3-(2-aminoethyl)-1H-indole-2-carboxylic acid CAS Name: acetic acid; 3-(2-aminoethyl)-1H-indole-2-carboxylic acid IUPAC Name: acetic acid; 3-(2-aminoethyl)-1H-indole-2-carboxylic acid Traditional Name: acetic acid; 3-(2-aminoethyl)-1H-indole-2-carboxylic acid Formula: C13H16N2O4 MolecularWeight: 264.27714

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1=CC=C2C(=C1)C(=C(N2)C(=O)O)CCN

Isomeric SMILES

CC(=O)O.C1=CC=C2C(=C1)C(=C(N2)C(=O)O)CCN

InChI

InChI=1S/C11H12N2O2.C2H4O2/c12-6-5-8-7-3-1-2-4-9(7)13-10(8)11(14)15;1-2(3)4/h1-4,13H,5-6,12H2,(H,14,15);1H3,(H,3,4)