Vitas-M small molecule compound

(E)-{1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene}(4-propoxyphenyl)methanolate

Catalog ID
STL047753
SMILES CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)CC[NH+]1CCOCC1)/[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 C26H30N2O5 MW 450.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N2O5/c1-2-16-33-21-10-8-20(9-11-21)24(29)22-23(19-6-4-3-5-7-19)28(26(31)25(22)30)13-12-27-14-17-32-18-15-27/h3-11,23,29H,2,12-18H2,1H3/b24-22+
InChIKey
PPMLLFUCLFEJSG-ZNTNEXAZSA-N
Synonyms
615276-41-0
(4E)4(HYDROXY(4PROPOXYPHENYL)METHYLIDENE)1(2MORPHOLIN4YLETHYL)5PHENYLPYRROLIDINE23DIONE
(E)(1(2(morpholin4ium4yl)ethyl)45dioxo2phenylpyrrolidin3ylidene)(4propoxyphenyl)methanolate
(E)(1(2MORPHOLIN4IUM4YLETHYL)45DIOXO2PHENYLPYRROLIDIN3YLIDENE)(4PROPOXYPHENYL)METHANOLATE
3HYDROXY1(2MORPHOLIN4YLETHYL)5PHENYL4((4PROPOXYPHENYL)CARBONYL)3PYRROLIN2ONE
615276410
CCCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CC(NH+)3CCOCC3)C4=CC=CC=C4)(O)
CCCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccccc1)CC(NH+)1CCOCC1)(O)
InChI=1SC26H30N2O5c1216332110820(91121)24(29)2223(196435719)28(26(31)25(22)30)131227141732181527h3112329H21218H21H3b2422+
MFCD18249126
ZINC000102883718
ZINC000102883720

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Available files

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