Vitas-M small molecule compound

6-{[2-(methoxycarbonyl)phenyl]carbamoyl}cyclohex-3-ene-1-carboxylic acid

Catalog ID
STK430126
SMILES COC(=O)c1ccccc1NC(=O)C1CC=CCC1C(=O)O

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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 C16H17NO5 MW 303.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17NO5/c1-22-16(21)12-8-4-5-9-13(12)17-14(18)10-6-2-3-7-11(10)15(19)20/h2-5,8-11H,6-7H2,1H3,(H,17,18)(H,19,20)
InChIKey
RBYLPSAYGSXZIO-UHFFFAOYSA-N
Synonyms

6(((2(METHOXYCARBONYL)PHENYL)AMINO)CARBONYL)3CYCLOHEXENE1CARBOXYLICACID
6((2(methoxycarbonyl)phenyl)carbamoyl)cyclohex3ene1carboxylicacid
6((2METHOXYCARBONYLPHENYL)CARBAMOYL)CYCLOHEX3ENE1CARBOXYLICACID
6(N(2(METHOXYCARBONYL)PHENYL)CARBAMOYL)CYCLOHEX3ENECARBOXYLICACID
COC(=O)C1=CC=CC=C1NC(=O)C2CC=CCC2C(=O)O
InChI=1SC16H17NO5c12216(21)12845913(12)1714(18)10623711(10)15(19)20h25811H67H21H3(H1718)(H1920)
MFCD01835123
ZINC000000473742
ZINC000000473745

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Available files

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