2-[3-(4-methoxyphenyl)-2-methyl-5-oxidanylidene-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-6-yl]ethanoic acid

Systemtic Name: 2-[3-(4-methoxyphenyl)-2-methyl-5-oxidanylidene-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-6-yl]ethanoic acid Openeye Name: 2-[3-(4-methoxyphenyl)-2-methyl-5-oxo-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-6-yl]acetic acid CAS Name: 2-[3-(4-methoxyphenyl)-2-methyl-5-oxo-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-6-yl]acetic acid IUPAC Name: 2-[3-(4-methoxyphenyl)-2-methyl-5-oxo-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-6-yl]acetic acid Traditional Name: 2-[5-keto-3-(4-methoxyphenyl)-2-methyl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-6-yl]acetic acid Formula: C16H17N3O4 MolecularWeight: 315.32388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC(=O)C(CN2N1)CC(=O)O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C2=NC(=O)C(CN2N1)CC(=O)O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C16H17N3O4/c1-9-14(10-3-5-12(23-2)6-4-10)15-17-16(22)11(7-13(20)21)8-19(15)18-9/h3-6,11,18H,7-8H2,1-2H3,(H,20,21)