ethyl 4-(1,3-benzodioxol-5-ylmethyl)-2-[(4-ethoxyphenyl)methylideneamino]-5-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 4-(1,3-benzodioxol-5-ylmethyl)-2-[(4-ethoxyphenyl)methylideneamino]-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 4-(1,3-benzodioxol-5-ylmethyl)-2-[(4-ethoxyphenyl)methyleneamino]-5-methyl-thiophene-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-ylmethyl)-2-[(4-ethoxyphenyl)methylideneamino]-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(1,3-benzodioxol-5-ylmethyl)-2-[(4-ethoxyphenyl)methylideneamino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[(4-ethoxybenzylidene)amino]-5-methyl-4-piperonyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H25NO5S MolecularWeight: 451.5347

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25NO5S/c1-4-28-19-9-6-17(7-10-19)14-26-24-23(25(27)29-5-2)20(16(3)32-24)12-18-8-11-21-22(13-18)31-15-30-21/h6-11,13-14H,4-5,12,15H2,1-3H3