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

Systemtic Name: methyl 4-(1,3-benzodioxol-5-ylmethyl)-2-[2-(4-dimethylaminophenyl)carbonyloxyethanoylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 4-(1,3-benzodioxol-5-ylmethyl)-2-[[2-[4-(dimethylamino)benzoyl]oxyacetyl]amino]-5-methyl-thiophene-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-ylmethyl)-2-[[2-[(4-dimethylaminophenyl)-oxomethoxy]-1-oxoethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(1,3-benzodioxol-5-ylmethyl)-2-[[2-[4-(dimethylamino)benzoyl]oxyacetyl]amino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[[2-[4-(dimethylamino)benzoyl]oxyacetyl]amino]-5-methyl-4-piperonyl-thiophene-3-carboxylic acid methyl ester Formula: C26H26N2O7S MolecularWeight: 510.55884

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C26H26N2O7S/c1-15-19(11-16-5-10-20-21(12-16)35-14-34-20)23(26(31)32-4)24(36-15)27-22(29)13-33-25(30)17-6-8-18(9-7-17)28(2)3/h5-10,12H,11,13-14H2,1-4H3,(H,27,29)