Vitas-M small molecule compound
methyl 3-[(4-carbamoylphenyl)carbamoyl]-5-nitrobenzoate
Catalog ID
STK039473
SMILES COC(=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)Nc1ccc(cc1)C(=O)N
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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 C16H13N3O6 MW 343.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N3O6/c1-25-16(22)11-6-10(7-13(8-11)19(23)24)15(21)18-12-4-2-9(3-5-12)14(17)20/h2-8H,1H3,(H2,17,20)(H,18,21)InChIKey
ZONYVXWRBZWWTC-UHFFFAOYSA-NSynonyms
349084-61-3349084613
COC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)N)(N+)(=O)(O)
COC(=O)c1cc(cc(c1)(N+)(=O)(O))C(=O)Nc1ccc(cc1)C(=O)N
InChI=1SC16H13N3O6c12516(22)11610(713(811)19(23)24)15(21)1812429(3512)14(17)20h28H1H3(H21720)(H1821)
METHYL3((4CARBAMOYLPHENYL)CARBAMOYL)5NITROBENZOATE
METHYL5(N(4CARBAMOYLPHENYL)CARBAMOYL)3NITROBENZOATE
MFCD02006778
STK039473
ZINC000000184092
ZINC00184092
ZINC184092
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