Vitas-M small molecule compound
3-{[2-(butan-2-yl)phenyl]carbamoyl}bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Catalog ID
STK475095
SMILES CCC(c1ccccc1NC(=O)C1C2C=CC(C1C(=O)O)C2)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 C19H23NO3 MW 313.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23NO3/c1-3-11(2)14-6-4-5-7-15(14)20-18(21)16-12-8-9-13(10-12)17(16)19(22)23/h4-9,11-13,16-17H,3,10H2,1-2H3,(H,20,21)(H,22,23)InChIKey
JYMVMKPGYLWTLT-UHFFFAOYSA-NSynonyms
2((2BUTAN2YLPHENYL)CARBAMOYL)BICYCLO(221)HEPT5ENE3CARBOXYLICACID
3((2(butan2yl)phenyl)carbamoyl)bicyclo(221)hept5ene2carboxylicacid
3(N(2(METHYLPROPYL)PHENYL)CARBAMOYL)BICYCLO(221)HEPT5ENE2CARBOXYLICACID
CCC(C)C1=CC=CC=C1NC(=O)C2C3CC(C2C(=O)O)C=C3
InChI=1SC19H23NO3c1311(2)14645715(14)2018(21)16128913(1012)17(16)19(22)23h4911131617H310H212H3(H2021)(H2223)
MFCD06067099
ZINC000100799290
ZINC000239125127
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