Vitas-M small molecule compound

Catalog ID
STL303337
SMILES CCC([C@@H](C(=O)O)NC(=O)N1CCCc2c1cccc2)C

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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 C16H22N2O3 MW 290.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N2O3/c1-3-11(2)14(15(19)20)17-16(21)18-10-6-8-12-7-4-5-9-13(12)18/h4-5,7,9,11,14H,3,6,8,10H2,1-2H3,(H,17,21)(H,19,20)/t11?,14-/m0/s1
InChIKey
YCXJWZMMTSVQPW-IAXJKZSUSA-N
Synonyms
1014405-49-2
(2S)2(34dihydro2Hquinoline1carbonylamino)3methylpentanoicacid
(2S3R)3methyl2(1234tetrahydroquinoline1carboxamido)pentanoicacid
1014405492
CCC((C@@H)(C(=O)O)NC(=O)N1CCCc2c1cccc2)C
CCC(C)C(C(=O)O)NC(=O)N1CCCC2=CC=CC=C21
InChI=1SC16H22N2O3c1311(2)14(15(19)20)1716(21)18106812745913(12)18h45791114H36810H212H3(H1721)(H1920)t11?14m0s1
ZINC000008992466
ZINC000013681086

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Available files

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