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

Systemtic Name: ethyl 4-(1,3-benzodioxol-5-ylmethyl)-2-[2-(4-tert-butylcyclohexyl)carbonyloxyethanoylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 4-(1,3-benzodioxol-5-ylmethyl)-2-[[2-(4-tert-butylcyclohexanecarbonyl)oxyacetyl]amino]-5-methyl-thiophene-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-ylmethyl)-2-[[2-[(4-tert-butylcyclohexyl)-oxomethoxy]-1-oxoethyl]amino]-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(1,3-benzodioxol-5-ylmethyl)-2-[[2-(4-tert-butylcyclohexanecarbonyl)oxyacetyl]amino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[[2-(4-tert-butylcyclohexanecarbonyl)oxyacetyl]amino]-5-methyl-4-piperonyl-thiophene-3-carboxylic acid ethyl ester Formula: C29H37NO7S MolecularWeight: 543.67158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1CC2=CC3=C(C=C2)OCO3)C)NC(=O)COC(=O)C4CCC(CC4)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1CC2=CC3=C(C=C2)OCO3)C)NC(=O)COC(=O)C4CCC(CC4)C(C)(C)C

InChI

InChI=1S/C29H37NO7S/c1-6-34-28(33)25-21(13-18-7-12-22-23(14-18)37-16-36-22)17(2)38-26(25)30-24(31)15-35-27(32)19-8-10-20(11-9-19)29(3,4)5/h7,12,14,19-20H,6,8-11,13,15-16H2,1-5H3,(H,30,31)