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

Systemtic Name: methyl 4-(1,3-benzodioxol-5-ylmethyl)-2-[2-(3,4-diethoxyphenyl)carbonyloxyethanoylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 4-(1,3-benzodioxol-5-ylmethyl)-2-[[2-(3,4-diethoxybenzoyl)oxyacetyl]amino]-5-methyl-thiophene-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-ylmethyl)-2-[[2-[(3,4-diethoxyphenyl)-oxomethoxy]-1-oxoethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(1,3-benzodioxol-5-ylmethyl)-2-[[2-(3,4-diethoxybenzoyl)oxyacetyl]amino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[[2-(3,4-diethoxybenzoyl)oxyacetyl]amino]-5-methyl-4-piperonyl-thiophene-3-carboxylic acid methyl ester Formula: C28H29NO9S MolecularWeight: 555.59616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)OCC(=O)NC2=C(C(=C(S2)C)CC3=CC4=C(C=C3)OCO4)C(=O)OC)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)OCC(=O)NC2=C(C(=C(S2)C)CC3=CC4=C(C=C3)OCO4)C(=O)OC)OCC

InChI

InChI=1S/C28H29NO9S/c1-5-34-20-10-8-18(13-23(20)35-6-2)27(31)36-14-24(30)29-26-25(28(32)33-4)19(16(3)39-26)11-17-7-9-21-22(12-17)38-15-37-21/h7-10,12-13H,5-6,11,14-15H2,1-4H3,(H,29,30)