Vitas-M small molecule compound
ethyl 4-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)benzoate
Catalog ID
STL445438
SMILES CCOC(=O)c1ccc(cc1)n1c(C)c2c(c1C)c(=O)cccc2OCC
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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 C22H23NO4 MW 365.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO4/c1-5-26-19-9-7-8-18(24)20-14(3)23(15(4)21(19)20)17-12-10-16(11-13-17)22(25)27-6-2/h7-13H,5-6H2,1-4H3InChIKey
AEOPCSPQTFPYAZ-UHFFFAOYSA-NSynonyms
780779-07-9780779079
CCOC1=CC=CC(=O)C2=C(N(C(=C12)C)C3=CC=C(C=C3)C(=O)OCC)C
ETHYL4(4ETHOXY13DIMETHYL8OXOCYCLOHEPTA(C)PYRROL2YL)BENZOATE
ethyl4(8ethoxy13dimethyl4oxocyclohepta(c)pyrrol2(4H)yl)benzoate
InChI=1SC22H23NO4c15261997818(24)2014(3)23(15(4)21(19)20)17121016(111317)22(25)2762h713H56H214H3
MFCD04146426
ZINC000001106352
ZINC01106352
ZINC1106352
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