Vitas-M small molecule compound

4-(benzylamino)-2-(4-chlorobenzyl)-4-oxobutanoic acid

Catalog ID
STL442294
SMILES O=C(CC(C(=O)O)Cc1ccc(cc1)Cl)NCc1ccccc1

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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 C18H18ClNO3 MW 331.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClNO3/c19-16-8-6-13(7-9-16)10-15(18(22)23)11-17(21)20-12-14-4-2-1-3-5-14/h1-9,15H,10-12H2,(H,20,21)(H,22,23)
InChIKey
JZEZADGIPUEMSC-UHFFFAOYSA-N
Synonyms

4(benzylamino)2((4chlorophenyl)methyl)4oxobutanoicacid
4(benzylamino)2(4chlorobenzyl)4oxobutanoicacid
C1=CC=C(C=C1)CNC(=O)CC(CC2=CC=C(C=C2)Cl)C(=O)O
InChI=1SC18H18ClNO3c19168613(7916)1015(18(22)23)1117(21)2012144213514h1915H1012H2(H2021)(H2223)
MFCD01841238
ZINC000005773618
ZINC000005773622

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Available files

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