Vitas-M small molecule compound

methyl (5Z)-5-[(2-hydroxynaphthalen-1-yl)methylidene]-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate

Catalog ID
STK160092
SMILES COC(=O)C1=C(C)N/C(=C\c2c(O)ccc3c2cccc3)/C1=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 C18H15NO4 MW 309.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15NO4/c1-10-16(18(22)23-2)17(21)14(19-10)9-13-12-6-4-3-5-11(12)7-8-15(13)20/h3-9,19-20H,1-2H3/b14-9-
InChIKey
NSWPQGGGWDEWOX-ZROIWOOFSA-N
Synonyms

CC1=C(C(=O)C(=CC2=C(C=CC3=CC=CC=C32)O)N1)C(=O)OC
COC(=O)C1=C(C)NC(=Cc2c(O)ccc3c2cccc3)C1=O
InChI=1SC18H15NO4c11016(18(22)232)17(21)14(1910)91312643511(12)7815(13)20h391920H12H3b149
METHYL(5Z)5((2HYDROXYNAPHTHALEN1YL)METHYLIDENE)2METHYL4OXO1HPYRROLE3CARBOXYLATE
METHYL(5Z)5((2HYDROXYNAPHTHALEN1YL)METHYLIDENE)2METHYL4OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD01988428
ZINC000018141618
ZINC18141618

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Available files

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