Vitas-M small molecule compound

3-{[(1-carboxycyclohexyl)carbamoyl]amino}benzoic acid

Catalog ID
STK658583
SMILES O=C(NC1(CCCCC1)C(=O)O)Nc1cccc(c1)C(=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 C15H18N2O5 MW 306.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N2O5/c18-12(19)10-5-4-6-11(9-10)16-14(22)17-15(13(20)21)7-2-1-3-8-15/h4-6,9H,1-3,7-8H2,(H,18,19)(H,20,21)(H2,16,17,22)
InChIKey
HLZVDFJNTDJAKN-UHFFFAOYSA-N
Synonyms
1212110-57-0
1212110570
3(((1carboxycyclohexyl)carbamoyl)amino)benzoicacid
3((1carboxycyclohexyl)carbamoylamino)benzoicacid
3(3(1carboxycyclohexyl)ureido)benzoicacid
C1CCC(CC1)(C(=O)O)NC(=O)NC2=CC=CC(=C2)C(=O)O
InChI=1SC15H18N2O5c1812(19)1054611(910)1614(22)1715(13(20)21)7213815h469H1378H2(H1819)(H2021)(H2161722)
MFCD18168429
ZINC000032095180
ZINC32095180

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Available files

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