methyl 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-[2-(2-nitrophenyl)carbonyloxyethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-[2-(2-nitrophenyl)carbonyloxyethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-[[2-(2-nitrobenzoyl)oxyacetyl]amino]thiophene-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-[[2-[(2-nitrophenyl)-oxomethoxy]-1-oxoethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-[[2-(2-nitrobenzoyl)oxyacetyl]amino]thiophene-3-carboxylate Traditional Name: 5-methyl-2-[[2-(2-nitrobenzoyl)oxyacetyl]amino]-4-piperonyl-thiophene-3-carboxylic acid methyl ester Formula: C24H20N2O9S MolecularWeight: 512.4886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)COC(=O)C2=CC=CC=C2[N+](=O)[O-])C(=O)OC)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)COC(=O)C2=CC=CC=C2[N+](=O)[O-])C(=O)OC)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H20N2O9S/c1-13-16(9-14-7-8-18-19(10-14)35-12-34-18)21(24(29)32-2)22(36-13)25-20(27)11-33-23(28)15-5-3-4-6-17(15)26(30)31/h3-8,10H,9,11-12H2,1-2H3,(H,25,27)