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

Systemtic Name: methyl 4-(1,3-benzodioxol-5-ylmethyl)-2-[2-(4-bromophenyl)carbonyloxyethanoylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 4-(1,3-benzodioxol-5-ylmethyl)-2-[[2-(4-bromobenzoyl)oxyacetyl]amino]-5-methyl-thiophene-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-ylmethyl)-2-[[2-[(4-bromophenyl)-oxomethoxy]-1-oxoethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(1,3-benzodioxol-5-ylmethyl)-2-[[2-(4-bromobenzoyl)oxyacetyl]amino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[[2-(4-bromobenzoyl)oxyacetyl]amino]-5-methyl-4-piperonyl-thiophene-3-carboxylic acid methyl ester Formula: C24H20BrNO7S MolecularWeight: 546.3871

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)COC(=O)C2=CC=C(C=C2)Br)C(=O)OC)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)COC(=O)C2=CC=C(C=C2)Br)C(=O)OC)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H20BrNO7S/c1-13-17(9-14-3-8-18-19(10-14)33-12-32-18)21(24(29)30-2)22(34-13)26-20(27)11-31-23(28)15-4-6-16(25)7-5-15/h3-8,10H,9,11-12H2,1-2H3,(H,26,27)