Vitas-M small molecule compound

3-{[2-(3-chlorophenyl)ethyl]carbamoyl}bicyclo[2.2.1]heptane-2-carboxylic acid

Catalog ID
STK479849
SMILES O=C(C1C2CCC(C1C(=O)O)C2)NCCc1cccc(c1)Cl

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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 C17H20ClNO3 MW 321.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20ClNO3/c18-13-3-1-2-10(8-13)6-7-19-16(20)14-11-4-5-12(9-11)15(14)17(21)22/h1-3,8,11-12,14-15H,4-7,9H2,(H,19,20)(H,21,22)
InChIKey
LBSALAHKZWDRNS-UHFFFAOYSA-N
Synonyms

2((2(3CHLOROPHENYL)ETHYLAMINO)OXOMETHYL)3BICYCLO(221)HEPTANECARBOXYLICACID
2(2(3CHLOROPHENYL)ETHYLCARBAMOYL)BICYCLO(221)HEPTANE3CARBOXYLICACID
3(((2(3CHLOROPHENYL)ETHYL)AMINO)CARBONYL)BICYCLO(221)HEPTANE2CARBOXYLICACID
3((2(3chlorophenyl)ethyl)carbamoyl)bicyclo(221)heptane2carboxylicacid
3(2(3CHLOROPHENYL)ETHYLCARBAMOYL)NORBORNANE2CARBOXYLICACID
3(N(2(3CHLOROPHENYL)ETHYL)CARBAMOYL)BICYCLO(221)HEPTANE2CARBOXYLICACID
C1CC2CC1C(C2C(=O)O)C(=O)NCCC3=CC(=CC=C3)Cl
InChI=1SC17H20ClNO3c181331210(813)671916(20)14114512(911)15(14)17(21)22h13811121415H479H2(H1920)(H2122)
MFCD06065165
ZINC000100615194
ZINC000136308017

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.