Vitas-M small molecule compound
methyl 4-{[(2E)-4-amino-4-oxobut-2-enoyl]amino}benzoate
Catalog ID
STL019563
SMILES COC(=O)c1ccc(cc1)NC(=O)/C=C/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 C12H12N2O4 MW 248.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N2O4/c1-18-12(17)8-2-4-9(5-3-8)14-11(16)7-6-10(13)15/h2-7H,1H3,(H2,13,15)(H,14,16)/b7-6+InChIKey
UPRIEMUVAZRXEV-VOTSOKGWSA-NSynonyms
316125-36-7316125367
COC(=O)C1=CC=C(C=C1)NC(=O)C=CC(=O)N
COC(=O)c1ccc(cc1)NC(=O)C=CC(=O)N
InChI=1SC12H12N2O4c11812(17)8249(538)1411(16)7610(13)15h27H1H3(H21315)(H1416)b76+
methyl4(((2E)4amino4oxobut2enoyl)amino)benzoate
METHYL4(((E)4AMINO4OXOBUT2ENOYL)AMINO)BENZOATE
METHYL4((2E)3CARBAMOYLPROP2ENOYLAMINO)BENZOATE
METHYL4((4AMINO4OXO2BUTENOYL)AMINO)BENZOATE
MFCD02080257
ZINC000000112217
ZINC000005981642
ZINC00112217
ZINC112217
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