Vitas-M small molecule compound

diethyl ethyl{3-[(4-nitrophenyl)amino]-3-oxopropyl}propanedioate

Catalog ID
STL326907
SMILES CCC(C(=O)OCC)(C(=O)OCC)CCC(=O)Nc1ccc(cc1)[N+](=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 C18H24N2O7 MW 380.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N2O7/c1-4-18(16(22)26-5-2,17(23)27-6-3)12-11-15(21)19-13-7-9-14(10-8-13)20(24)25/h7-10H,4-6,11-12H2,1-3H3,(H,19,21)
InChIKey
PKSLQJXUBLGEAF-UHFFFAOYSA-N
Synonyms
336177-67-4
2ETHYL2(2(4NITROPHENYLCARBAMOYL)ETHYL)MALONICACIDDIETHYLESTER
336177674
CCC(C(=O)OCC)(C(=O)OCC)CCC(=O)Nc1ccc(cc1)(N+)(=O)(O)
CCC(CCC(=O)NC1=CC=C(C=C1)(N+)(=O)(O))(C(=O)OCC)C(=O)OCC
diethyl2ethyl2(3((4nitrophenyl)amino)3oxopropyl)malonate
DIETHYL2ETHYL2(3(4NITROANILINO)3OXOPROPYL)PROPANEDIOATE
diethylethyl(3((4nitrophenyl)amino)3oxopropyl)propanedioate
InChI=1SC18H24N2O7c1418(16(22)265217(23)2763)121115(21)19137914(10813)20(24)25h710H461112H213H3(H1921)
MFCD01817294
ZINC000004844074
ZINC04844074
ZINC4844074

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Available files

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