Vitas-M small molecule compound
tert-butyl 5-hydroxy-5-(4-methoxyphenyl)-3-methyl-4,5-dihydro-1H-pyrazole-1-carboxylate
Catalog ID
STK081046
SMILES COc1ccc(cc1)C1(O)CC(=NN1C(=O)OC(C)(C)C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C16H22N2O4 MW 306.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N2O4/c1-11-10-16(20,12-6-8-13(21-5)9-7-12)18(17-11)14(19)22-15(2,3)4/h6-9,20H,10H2,1-5H3InChIKey
YITAQKPNNZELDO-UHFFFAOYSA-NSynonyms
CC1=NN(C(C1)(C2=CC=C(C=C2)OC)O)C(=O)OC(C)(C)C
COc1ccc(cc1)C1(O)CC(=NN1C(=O)OC(C)(C)C)C
InChI=1SC16H22N2O4c1111016(20126813(215)9712)18(1711)14(19)2215(23)4h6920H10H215H3
MFCD02214585
STK081046
TERTBUTYL5HYDROXY5(4METHOXYPHENYL)3METHYL2PYRAZOLINECARBOXYLATE
TERTBUTYL5HYDROXY5(4METHOXYPHENYL)3METHYL45DIHYDRO1HPYRAZOLE1CARBOXYLATE
TERTBUTYL5HYDROXY5(4METHOXYPHENYL)3METHYL4HPYRAZOLE1CARBOXYLATE
ZINC000004671813
ZINC000004671815
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