ethyl 4-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[(3-methoxy-4-propoxy-phenyl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[(3-methoxy-4-propoxy-phenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[(3-methoxy-4-propoxy-benzoyl)amino]thiophene-3-carboxylate CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[[(3-methoxy-4-propoxyphenyl)-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[(3-methoxy-4-propoxybenzoyl)amino]thiophene-3-carboxylate Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-[(3-methoxy-4-propoxy-benzoyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C26H27NO7S MolecularWeight: 497.56008

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)NC2=C(C(=CS2)C3COC4=CC=CC=C4O3)C(=O)OCC)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)NC2=C(C(=CS2)C3COC4=CC=CC=C4O3)C(=O)OCC)OC

InChI

InChI=1S/C26H27NO7S/c1-4-12-32-19-11-10-16(13-21(19)30-3)24(28)27-25-23(26(29)31-5-2)17(15-35-25)22-14-33-18-8-6-7-9-20(18)34-22/h6-11,13,15,22H,4-5,12,14H2,1-3H3,(H,27,28)