3-[[1-[(2-methylphenyl)methyl]-2-oxidanyl-4-oxidanylidene-pyridin-3-yl]carbamoylamino]propanoic acid

Systemtic Name: 3-[[1-[(2-methylphenyl)methyl]-2-oxidanyl-4-oxidanylidene-pyridin-3-yl]carbamoylamino]propanoic acid Openeye Name: 3-[[2-hydroxy-1-(o-tolylmethyl)-4-oxo-3-pyridyl]carbamoylamino]propanoic acid CAS Name: 3-[[[[2-hydroxy-1-[(2-methylphenyl)methyl]-4-oxo-3-pyridinyl]amino]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[2-hydroxy-1-[(2-methylphenyl)methyl]-4-oxopyridin-3-yl]carbamoylamino]propanoic acid Traditional Name: 3-[[2-hydroxy-4-keto-1-(2-methylbenzyl)-3-pyridyl]carbamoylamino]propionic acid Formula: C17H19N3O5 MolecularWeight: 345.34986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=CC(=O)C(=C2O)NC(=O)NCCC(=O)O

Isomeric SMILES

CC1=CC=CC=C1CN2C=CC(=O)C(=C2O)NC(=O)NCCC(=O)O

InChI

InChI=1S/C17H19N3O5/c1-11-4-2-3-5-12(11)10-20-9-7-13(21)15(16(20)24)19-17(25)18-8-6-14(22)23/h2-5,7,9,24H,6,8,10H2,1H3,(H,22,23)(H2,18,19,25)