2-[[2-ethanoyl-5-(3,4,5-trimethoxyphenyl)-3,4-dihydropyrazol-3-yl]amino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[[2-ethanoyl-5-(3,4,5-trimethoxyphenyl)-3,4-dihydropyrazol-3-yl]amino]-3-oxidanyl-propanoic acid Openeye Name: 2-[[2-acetyl-5-(3,4,5-trimethoxyphenyl)-3,4-dihydropyrazol-3-yl]amino]-3-hydroxy-propanoic acid CAS Name: 2-[[2-acetyl-5-(3,4,5-trimethoxyphenyl)-3,4-dihydropyrazol-3-yl]amino]-3-hydroxypropanoic acid IUPAC Name: 2-[[2-acetyl-5-(3,4,5-trimethoxyphenyl)-3,4-dihydropyrazol-3-yl]amino]-3-hydroxypropanoic acid Traditional Name: 2-[[2-acetyl-5-(3,4,5-trimethoxyphenyl)-2-pyrazolin-3-yl]amino]-3-hydroxy-propionic acid Formula: C17H23N3O7 MolecularWeight: 381.38042

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CC(=N1)C2=CC(=C(C(=C2)OC)OC)OC)NC(CO)C(=O)O

Isomeric SMILES

CC(=O)N1C(CC(=N1)C2=CC(=C(C(=C2)OC)OC)OC)NC(CO)C(=O)O

InChI

InChI=1S/C17H23N3O7/c1-9(22)20-15(18-12(8-21)17(23)24)7-11(19-20)10-5-13(25-2)16(27-4)14(6-10)26-3/h5-6,12,15,18,21H,7-8H2,1-4H3,(H,23,24)