3-[3-(carboxymethyl)-1-methyl-indol-2-yl]propanoic acid

Systemtic Name: 3-[3-(carboxymethyl)-1-methyl-indol-2-yl]propanoic acid Openeye Name: 3-[3-(carboxymethyl)-1-methyl-indol-2-yl]propanoic acid CAS Name: 3-[3-(carboxymethyl)-1-methyl-2-indolyl]propanoic acid IUPAC Name: 3-[3-(carboxymethyl)-1-methylindol-2-yl]propanoic acid Traditional Name: 3-[3-(carboxymethyl)-1-methyl-indol-2-yl]propionic acid Formula: C14H15NO4 MolecularWeight: 261.2732

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1CCC(=O)O)CC(=O)O

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1CCC(=O)O)CC(=O)O

InChI

InChI=1S/C14H15NO4/c1-15-11-5-3-2-4-9(11)10(8-14(18)19)12(15)6-7-13(16)17/h2-5H,6-8H2,1H3,(H,16,17)(H,18,19)