Vitas-M small molecule compound
2-[(4-methyl-2-nitrophenyl)carbamoyl]-3-nitrobenzoic acid
Catalog ID
STK672230
SMILES Cc1ccc(c(c1)[N+](=O)[O-])NC(=O)c1c(cccc1[N+](=O)[O-])C(=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 C15H11N3O7 MW 345.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11N3O7/c1-8-5-6-10(12(7-8)18(24)25)16-14(19)13-9(15(20)21)3-2-4-11(13)17(22)23/h2-7H,1H3,(H,16,19)(H,20,21)InChIKey
RUTRIPZHMCLWJH-UHFFFAOYSA-NSynonyms
2((4METHYL2NITROPHENYL)CARBAMOYL)3NITROBENZOICACID
CC1=CC(=C(C=C1)NC(=O)C2=C(C=CC=C2(N+)(=O)(O))C(=O)O)(N+)(=O)(O)
Cc1ccc(c(c1)(N+)(=O)(O))NC(=O)c1c(cccc1(N+)(=O)(O))C(=O)O
InChI=1SC15H11N3O7c185610(12(78)18(24)25)1614(19)139(15(20)21)32411(13)17(22)23h27H1H3(H1619)(H2021)
MFCD00823319
ZINC000004459945
ZINC4459945
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