[(2R)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxidanylidene-butan-2-yl] thiophene-2-carboxylate

Systemtic Name: [(2R)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxidanylidene-butan-2-yl] thiophene-2-carboxylate Openeye Name: [(1R)-1-(1,3-benzodioxol-5-ylmethylcarbamoyl)propyl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [(2R)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxobutan-2-yl] ester IUPAC Name: [(2R)-1-(1,3-benzodioxol-5-ylmethylamino)-1-oxobutan-2-yl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [(1R)-1-(piperonylcarbamoyl)propyl] ester Formula: C17H17NO5S MolecularWeight: 347.38558

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC2=C(C=C1)OCO2)OC(=O)C3=CC=CS3

Isomeric SMILES

CC[C@H](C(=O)NCC1=CC2=C(C=C1)OCO2)OC(=O)C3=CC=CS3

InChI

InChI=1S/C17H17NO5S/c1-2-12(23-17(20)15-4-3-7-24-15)16(19)18-9-11-5-6-13-14(8-11)22-10-21-13/h3-8,12H,2,9-10H2,1H3,(H,18,19)/t12-/m1/s1