methyl 2-[2-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-yl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-yl)acetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[2-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-yl)-1-oxoethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-(1,4-dioxa-8-azoniaspiro[4.5]decan-8-yl)acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C15H21N2O5S+ MolecularWeight: 341.40264

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1)NC(=O)C[NH+]2CCC3(CC2)OCCO3

Isomeric SMILES

COC(=O)C1=C(SC=C1)NC(=O)C[NH+]2CCC3(CC2)OCCO3

InChI

InChI=1S/C15H20N2O5S/c1-20-14(19)11-2-9-23-13(11)16-12(18)10-17-5-3-15(4-6-17)21-7-8-22-15/h2,9H,3-8,10H2,1H3,(H,16,18)/p+1