Vitas-M small molecule compound

dimethyl 5-{[(4-chlorophenyl)acetyl]amino}benzene-1,3-dicarboxylate

Catalog ID
STK092706
SMILES COC(=O)c1cc(NC(=O)Cc2ccc(cc2)Cl)cc(c1)C(=O)OC

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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 C18H16ClNO5 MW 361.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16ClNO5/c1-24-17(22)12-8-13(18(23)25-2)10-15(9-12)20-16(21)7-11-3-5-14(19)6-4-11/h3-6,8-10H,7H2,1-2H3,(H,20,21)
InChIKey
AEELENLFAZDUNL-UHFFFAOYSA-N
Synonyms
349419-54-1
349419541
5(2(4CHLOROPHENYL)ACETYLAMINO)ISOPHTHALICACIDDIMETHYLESTER
COC(=O)C1=CC(=CC(=C1)NC(=O)CC2=CC=C(C=C2)Cl)C(=O)OC
COC(=O)c1cc(NC(=O)Cc2ccc(cc2)Cl)cc(c1)C(=O)OC
DIMETHYL5(((4CHLOROPHENYL)ACETYL)AMINO)BENZENE13DICARBOXYLATE
DIMETHYL5(((4CHLOROPHENYL)ACETYL)AMINO)ISOPHTHALATE
DIMETHYL5((2(4CHLOROPHENYL)ACETYL)AMINO)BENZENE13DICARBOXYLATE
InChI=1SC18H16ClNO5c12417(22)12813(18(23)252)1015(912)2016(21)7113514(19)6411h36810H7H212H3(H2021)
METHYL5(2(4CHLOROPHENYL)ACETYLAMINO)3(METHOXYCARBONYL)BENZOATE
MFCD02038791
STK092706
ZINC000001088656
ZINC01088656
ZINC1088656

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Available files

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