2-[[3-(4-methoxyphenyl)-7-oxidanyl-4-(pyrazol-1-ylmethyl)-[1,2]oxazolo[4,5-c]pyridin-6-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[3-(4-methoxyphenyl)-7-oxidanyl-4-(pyrazol-1-ylmethyl)-[1,2]oxazolo[4,5-c]pyridin-6-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[7-hydroxy-3-(4-methoxyphenyl)-4-(pyrazol-1-ylmethyl)isoxazolo[4,5-c]pyridine-6-carbonyl]amino]acetic acid CAS Name: 2-[[[7-hydroxy-3-(4-methoxyphenyl)-4-(1-pyrazolylmethyl)-6-isoxazolo[4,5-c]pyridinyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[7-hydroxy-3-(4-methoxyphenyl)-4-(pyrazol-1-ylmethyl)-[1,2]oxazolo[4,5-c]pyridine-6-carbonyl]amino]acetic acid Traditional Name: 2-[[7-hydroxy-3-(4-methoxyphenyl)-4-(pyrazol-1-ylmethyl)isoxazolo[4,5-c]pyridine-6-carbonyl]amino]acetic acid Formula: C20H17N5O6 MolecularWeight: 423.37888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NOC3=C2C(=NC(=C3O)C(=O)NCC(=O)O)CN4C=CC=N4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC3=C2C(=NC(=C3O)C(=O)NCC(=O)O)CN4C=CC=N4

InChI

InChI=1S/C20H17N5O6/c1-30-12-5-3-11(4-6-12)16-15-13(10-25-8-2-7-22-25)23-17(18(28)19(15)31-24-16)20(29)21-9-14(26)27/h2-8,28H,9-10H2,1H3,(H,21,29)(H,26,27)