ethyl 4-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-2-(2-phenoxyethanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-2-(2-phenoxyethanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-2-[(2-phenoxyacetyl)amino]thiophene-3-carboxylate CAS Name: 4-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-2-[(1-oxo-2-phenoxyethyl)amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-2-[(2-phenoxyacetyl)amino]thiophene-3-carboxylate Traditional Name: 4-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-2-[(2-phenoxyacetyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C23H21NO6S MolecularWeight: 439.48094

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2COC3=CC=CC=C3O2)NC(=O)COC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(SC=C1[C@H]2COC3=CC=CC=C3O2)NC(=O)COC4=CC=CC=C4

InChI

InChI=1S/C23H21NO6S/c1-2-27-23(26)21-16(19-12-29-17-10-6-7-11-18(17)30-19)14-31-22(21)24-20(25)13-28-15-8-4-3-5-9-15/h3-11,14,19H,2,12-13H2,1H3,(H,24,25)/t19-/m1/s1