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

Systemtic Name: 2-azanyl-4-[(1-methylindol-2-yl)carbonylamino]-3-oxidanylidene-2-(2-oxidanylideneethyl)butanoic acid Openeye Name: 2-amino-4-[(1-methylindole-2-carbonyl)amino]-3-oxo-2-(2-oxoethyl)butanoic acid CAS Name: 2-amino-4-[[(1-methyl-2-indolyl)-oxomethyl]amino]-3-oxo-2-(2-oxoethyl)butanoic acid IUPAC Name: 2-amino-4-[(1-methylindole-2-carbonyl)amino]-3-oxo-2-(2-oxoethyl)butanoic acid Traditional Name: 2-amino-3-keto-2-(2-ketoethyl)-4-[(1-methylindole-2-carbonyl)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)C(CC=O)(C(=O)O)N

Isomeric SMILES

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

InChI

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