methyl 3-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]carbonylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: methyl 3-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]carbonylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: methyl 3-[[(3R)-2,3-dihydro-1,4-benzodioxine-3-carbonyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]-oxomethyl]amino]-5-phenyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[(3R)-2,3-dihydro-1,4-benzodioxine-3-carbonyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-carbonyl]amino]-5-phenyl-thiophene-2-carboxylic acid methyl ester Formula: C21H17NO5S MolecularWeight: 395.42838

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

COC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)[C@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C21H17NO5S/c1-25-21(24)19-14(11-18(28-19)13-7-3-2-4-8-13)22-20(23)17-12-26-15-9-5-6-10-16(15)27-17/h2-11,17H,12H2,1H3,(H,22,23)/t17-/m1/s1