2-isocyanato-3-(1-methylindol-3-yl)propanoic acid

Systemtic Name: 2-isocyanato-3-(1-methylindol-3-yl)propanoic acid Openeye Name: 2-isocyanato-3-(1-methylindol-3-yl)propanoic acid CAS Name: 2-isocyanato-3-(1-methyl-3-indolyl)propanoic acid IUPAC Name: 2-isocyanato-3-(1-methylindol-3-yl)propanoic acid Traditional Name: 2-isocyanato-3-(1-methylindol-3-yl)propionic acid Formula: C13H12N2O3 MolecularWeight: 244.24598

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)CC(C(=O)O)N=C=O

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)CC(C(=O)O)N=C=O

InChI

InChI=1S/C13H12N2O3/c1-15-7-9(6-11(13(17)18)14-8-16)10-4-2-3-5-12(10)15/h2-5,7,11H,6H2,1H3,(H,17,18)