3-(1H-indol-3-yl)-2-[(1-oxidanyl-1-oxidanylidene-propan-2-yl)carbamoylamino]propanoic acid

Systemtic Name: 3-(1H-indol-3-yl)-2-[(1-oxidanyl-1-oxidanylidene-propan-2-yl)carbamoylamino]propanoic acid Openeye Name: 2-[(2-hydroxy-1-methyl-2-oxo-ethyl)carbamoylamino]-3-(1H-indol-3-yl)propanoic acid CAS Name: 2-[[[(1-hydroxy-1-oxopropan-2-yl)amino]-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: 2-[(1-hydroxy-1-oxopropan-2-yl)carbamoylamino]-3-(1H-indol-3-yl)propanoic acid Traditional Name: 2-[(2-hydroxy-2-keto-1-methyl-ethyl)carbamoylamino]-3-(1H-indol-3-yl)propionic acid Formula: C15H17N3O5 MolecularWeight: 319.31258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)O

Isomeric SMILES

CC(C(=O)O)NC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C15H17N3O5/c1-8(13(19)20)17-15(23)18-12(14(21)22)6-9-7-16-11-5-3-2-4-10(9)11/h2-5,7-8,12,16H,6H2,1H3,(H,19,20)(H,21,22)(H2,17,18,23)