Vitas-M small molecule compound
3-[(4-methoxyphenyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Catalog ID
STK430164
SMILES COc1ccc(cc1)NC(=O)C1C2C=CC(C1C(=O)O)C2
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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 C16H17NO4 MW 287.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17NO4/c1-21-12-6-4-11(5-7-12)17-15(18)13-9-2-3-10(8-9)14(13)16(19)20/h2-7,9-10,13-14H,8H2,1H3,(H,17,18)(H,19,20)InChIKey
RVWGVVNUECLEFH-UHFFFAOYSA-NSynonyms
66662-11-1(1S2R3R4R)3((4METHOXYPHENYL)CARBAMOYL)BICYCLO(221)HEPT5ENE2CARBOXYLICACID
2((4METHOXYPHENYL)CARBAMOYL)BICYCLO(221)HEPT5ENE3CARBOXYLICACID
3(((4METHOXYPHENYL)AMINO)CARBONYL)BICYCLO(221)HEPT5ENE2CARBOXYLICACID
3((4methoxyphenyl)carbamoyl)bicyclo(221)hept5ene2carboxylicacid
3(N(4METHOXYPHENYL)CARBAMOYL)BICYCLO(221)HEPT5ENE2CARBOXYLICACID
66662111
COC1=CC=C(C=C1)NC(=O)C2C3CC(C2C(=O)O)C=C3
InChI=1SC16H17NO4c121126411(5712)1715(18)1392310(89)14(13)16(19)20h279101314H8H21H3(H1718)(H1920)
MFCD00167700
ZINC000100293266
ZINC000239203166
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