3-[2-[(1-methylindol-2-yl)carbonylamino]ethanoylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[2-[(1-methylindol-2-yl)carbonylamino]ethanoylamino]-4-oxidanylidene-butanoic acid Openeye Name: 3-[[2-[(1-methylindole-2-carbonyl)amino]acetyl]amino]-4-oxo-butanoic acid CAS Name: 3-[[2-[[(1-methyl-2-indolyl)-oxomethyl]amino]-1-oxoethyl]amino]-4-oxobutanoic acid IUPAC Name: 3-[[2-[(1-methylindole-2-carbonyl)amino]acetyl]amino]-4-oxobutanoic acid Traditional Name: 4-keto-3-[[2-[(1-methylindole-2-carbonyl)amino]acetyl]amino]butyric acid Formula: C16H17N3O5 MolecularWeight: 331.32328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C=C1C(=O)NCC(=O)NC(CC(=O)O)C=O

Isomeric SMILES

CN1C2=CC=CC=C2C=C1C(=O)NCC(=O)NC(CC(=O)O)C=O

InChI

InChI=1S/C16H17N3O5/c1-19-12-5-3-2-4-10(12)6-13(19)16(24)17-8-14(21)18-11(9-20)7-15(22)23/h2-6,9,11H,7-8H2,1H3,(H,17,24)(H,18,21)(H,22,23)