Vitas-M small molecule compound
3-{[4-(dimethylamino)phenyl]carbamoyl}-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Catalog ID
STK458482
SMILES O=C(C1C2C=CC(C1C(=O)O)O2)Nc1ccc(cc1)N(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 C16H18N2O4 MW 302.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O4/c1-18(2)10-5-3-9(4-6-10)17-15(19)13-11-7-8-12(22-11)14(13)16(20)21/h3-8,11-14H,1-2H3,(H,17,19)(H,20,21)InChIKey
AMIHHHFIWGMKSA-UHFFFAOYSA-NSynonyms
2((4(dimethylamino)phenyl)carbamoyl)7oxabicyclo(221)hept5ene3carboxylicacid
2((4DIMETHYLAMINOPHENYL)CARBAMOYL)7OXABICYCLO(221)HEPT5ENE3CARBOXYLICACID
3((4(DIMETHYLAMINO)ANILINO)CARBONYL)7OXABICYCLO(221)HEPT5ENE2CARBOXYLICACID
3((4(dimethylamino)phenyl)carbamoyl)7oxabicyclo(221)hept5ene2carboxylicacid
3(N(4(DIMETHYLAMINO)PHENYL)CARBAMOYL)7OXABICYCLO(221)HEPT5ENE2CARBOXYLICACID
CN(C)C1=CC=C(C=C1)NC(=O)C2C3C=CC(C2C(=O)O)O3
InChI=1SC16H18N2O4c118(2)10539(4610)1715(19)13117812(2211)14(13)16(20)21h381114H12H3(H1719)(H2021)
MFCD01192148
ZINC000169309757
ZINC000239274645
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