Vitas-M small molecule compound
methyl 3-{[3-(diethylamino)propyl]carbamoyl}-5-nitrobenzoate
Catalog ID
STL260719
SMILES CCN(CCCNC(=O)c1cc(cc(c1)C(=O)OC)[N+](=O)[O-])CC
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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 C16H23N3O5 MW 337.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H23N3O5/c1-4-18(5-2)8-6-7-17-15(20)12-9-13(16(21)24-3)11-14(10-12)19(22)23/h9-11H,4-8H2,1-3H3,(H,17,20)InChIKey
CWERWBCGVHHEFV-UHFFFAOYSA-NSynonyms
313480-52-3313480523
CCN(CC)CCCNC(=O)C1=CC(=CC(=C1)(N+)(=O)(O))C(=O)OC
CCN(CCCNC(=O)c1cc(cc(c1)C(=O)OC)(N+)(=O)(O))CC
InChI=1SC16H23N3O5c1418(52)8671715(20)12913(16(21)243)1114(1012)19(22)23h911H48H213H3(H1720)
methyl3((3(diethylamino)propyl)carbamoyl)5nitrobenzoate
METHYL3(3(DIETHYLAMINO)PROPYLCARBAMOYL)5NITROBENZOATE
METHYL5(N(3(DIETHYLAMINO)PROPYL)CARBAMOYL)3NITROBENZOATE
MFCD01196935
ZINC000002744810
ZINC2744810
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