ethyl 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-(naphthalen-1-ylmethylideneamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-(naphthalen-1-ylmethylideneamino)thiophene-3-carboxylate Openeye Name: ethyl 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-(1-naphthylmethyleneamino)thiophene-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-(1-naphthalenylmethylideneamino)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(1,3-benzodioxol-5-ylmethyl)-5-methyl-2-(naphthalen-1-ylmethylideneamino)thiophene-3-carboxylate Traditional Name: 5-methyl-2-(1-naphthylmethyleneamino)-4-piperonyl-thiophene-3-carboxylic acid ethyl ester Formula: C27H23NO4S MolecularWeight: 457.54082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1CC2=CC3=C(C=C2)OCO3)C)N=CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1CC2=CC3=C(C=C2)OCO3)C)N=CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C27H23NO4S/c1-3-30-27(29)25-22(13-18-11-12-23-24(14-18)32-16-31-23)17(2)33-26(25)28-15-20-9-6-8-19-7-4-5-10-21(19)20/h4-12,14-15H,3,13,16H2,1-2H3