(7-chloranyl-1,3-benzodioxol-5-yl)methyl 5-(cyclopropylcarbonylamino)thiophene-2-carboxylate

Systemtic Name: (7-chloranyl-1,3-benzodioxol-5-yl)methyl 5-(cyclopropylcarbonylamino)thiophene-2-carboxylate Openeye Name: (7-chloro-1,3-benzodioxol-5-yl)methyl 5-(cyclopropanecarbonylamino)thiophene-2-carboxylate CAS Name: 5-[[cyclopropyl(oxo)methyl]amino]-2-thiophenecarboxylic acid (7-chloro-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (7-chloro-1,3-benzodioxol-5-yl)methyl 5-(cyclopropanecarbonylamino)thiophene-2-carboxylate Traditional Name: 5-(cyclopropanecarbonylamino)thiophene-2-carboxylic acid (7-chloro-1,3-benzodioxol-5-yl)methyl ester Formula: C17H14ClNO5S MolecularWeight: 379.81476

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=C(S2)C(=O)OCC3=CC4=C(C(=C3)Cl)OCO4

Isomeric SMILES

C1CC1C(=O)NC2=CC=C(S2)C(=O)OCC3=CC4=C(C(=C3)Cl)OCO4

InChI

InChI=1S/C17H14ClNO5S/c18-11-5-9(6-12-15(11)24-8-23-12)7-22-17(21)13-3-4-14(25-13)19-16(20)10-1-2-10/h3-6,10H,1-2,7-8H2,(H,19,20)