ethyl 2-[2-[4-(4-methoxyphenyl)carbonylpiperidin-1-ium-1-yl]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[4-(4-methoxyphenyl)carbonylpiperidin-1-ium-1-yl]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[4-(4-methoxybenzoyl)piperidin-1-ium-1-yl]acetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[2-[4-[(4-methoxyphenyl)-oxomethyl]-1-piperidin-1-iumyl]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[4-(4-methoxybenzoyl)piperidin-1-ium-1-yl]acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-(4-p-anisoylpiperidin-1-ium-1-yl)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C22H27N2O5S+ MolecularWeight: 431.52518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1)NC(=O)C[NH+]2CCC(CC2)C(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)C1=C(SC=C1)NC(=O)C[NH+]2CCC(CC2)C(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H26N2O5S/c1-3-29-22(27)18-10-13-30-21(18)23-19(25)14-24-11-8-16(9-12-24)20(26)15-4-6-17(28-2)7-5-15/h4-7,10,13,16H,3,8-9,11-12,14H2,1-2H3,(H,23,25)/p+1