ethyl 2-(1,3-benzodioxol-5-ylmethylideneamino)-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-(1,3-benzodioxol-5-ylmethylideneamino)-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-(1,3-benzodioxol-5-ylmethyleneamino)-4-phenyl-thiophene-3-carboxylate CAS Name: 2-(1,3-benzodioxol-5-ylmethylideneamino)-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(1,3-benzodioxol-5-ylmethylideneamino)-4-phenylthiophene-3-carboxylate Traditional Name: 4-phenyl-2-(piperonylideneamino)thiophene-3-carboxylic acid ethyl ester Formula: C21H17NO4S MolecularWeight: 379.42898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)N=CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)N=CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H17NO4S/c1-2-24-21(23)19-16(15-6-4-3-5-7-15)12-27-20(19)22-11-14-8-9-17-18(10-14)26-13-25-17/h3-12H,2,13H2,1H3