ethyl 5-(1,3-benzodioxol-5-ylmethylidene)-2-(naphthalen-1-ylamino)-4-oxidanylidene-thiophene-3-carboxylate

Systemtic Name: ethyl 5-(1,3-benzodioxol-5-ylmethylidene)-2-(naphthalen-1-ylamino)-4-oxidanylidene-thiophene-3-carboxylate Openeye Name: ethyl 5-(1,3-benzodioxol-5-ylmethylene)-2-(1-naphthylamino)-4-oxo-thiophene-3-carboxylate CAS Name: 5-(1,3-benzodioxol-5-ylmethylidene)-2-(1-naphthalenylamino)-4-oxo-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(1,3-benzodioxol-5-ylmethylidene)-2-(naphthalen-1-ylamino)-4-oxothiophene-3-carboxylate Traditional Name: 4-keto-2-(1-naphthylamino)-5-piperonylidene-thiophene-3-carboxylic acid ethyl ester Formula: C25H19NO5S MolecularWeight: 445.48706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=CC2=CC3=C(C=C2)OCO3)C1=O)NC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CCOC(=O)C1=C(SC(=CC2=CC3=C(C=C2)OCO3)C1=O)NC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C25H19NO5S/c1-2-29-25(28)22-23(27)21(13-15-10-11-19-20(12-15)31-14-30-19)32-24(22)26-18-9-5-7-16-6-3-4-8-17(16)18/h3-13,26H,2,14H2,1H3