ethyl 4-(1,3-benzodioxol-5-yloxy)-3-(thiophen-2-ylcarbonylamino)benzoate

Systemtic Name: ethyl 4-(1,3-benzodioxol-5-yloxy)-3-(thiophen-2-ylcarbonylamino)benzoate Openeye Name: ethyl 4-(1,3-benzodioxol-5-yloxy)-3-(thiophene-2-carbonylamino)benzoate CAS Name: 4-(1,3-benzodioxol-5-yloxy)-3-[[oxo(thiophen-2-yl)methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(1,3-benzodioxol-5-yloxy)-3-(thiophene-2-carbonylamino)benzoate Traditional Name: 4-(1,3-benzodioxol-5-yloxy)-3-(2-thenoylamino)benzoic acid ethyl ester Formula: C21H17NO6S MolecularWeight: 411.42778

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)OC2=CC3=C(C=C2)OCO3)NC(=O)C4=CC=CS4

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)OC2=CC3=C(C=C2)OCO3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C21H17NO6S/c1-2-25-21(24)13-5-7-16(15(10-13)22-20(23)19-4-3-9-29-19)28-14-6-8-17-18(11-14)27-12-26-17/h3-11H,2,12H2,1H3,(H,22,23)