3-[[2-(4-ethoxy-4-oxidanylidene-butyl)-3-oxidanylidene-[1,2,4]triazolo[4,3-a]pyridin-6-yl]carbonylamino]-2-(phenylmethoxycarbonylamino)propanoic acid

Systemtic Name: 3-[[2-(4-ethoxy-4-oxidanylidene-butyl)-3-oxidanylidene-[1,2,4]triazolo[4,3-a]pyridin-6-yl]carbonylamino]-2-(phenylmethoxycarbonylamino)propanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-3-[[2-(4-ethoxy-4-oxo-butyl)-3-oxo-[1,2,4]triazolo[4,3-a]pyridine-6-carbonyl]amino]propanoic acid CAS Name: 3-[[[2-(4-ethoxy-4-oxobutyl)-3-oxo-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-oxomethyl]amino]-2-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: 3-[[2-(4-ethoxy-4-oxobutyl)-3-oxo-[1,2,4]triazolo[4,3-a]pyridine-6-carbonyl]amino]-2-(phenylmethoxycarbonylamino)propanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-3-[[2-(4-ethoxy-4-keto-butyl)-3-keto-[1,2,4]triazolo[4,3-a]pyridine-6-carbonyl]amino]propionic acid Formula: C24H27N5O8 MolecularWeight: 513.49988

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1C(=O)N2C=C(C=CC2=N1)C(=O)NCC(C(=O)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CCCN1C(=O)N2C=C(C=CC2=N1)C(=O)NCC(C(=O)O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H27N5O8/c1-2-36-20(30)9-6-12-29-24(35)28-14-17(10-11-19(28)27-29)21(31)25-13-18(22(32)33)26-23(34)37-15-16-7-4-3-5-8-16/h3-5,7-8,10-11,14,18H,2,6,9,12-13,15H2,1H3,(H,25,31)(H,26,34)(H,32,33)