cyclohexylmethyl-[2-[(3-ethoxycarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: cyclohexylmethyl-[2-[(3-ethoxycarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: cyclohexylmethyl-[2-[(3-ethoxycarbonyl-2-thienyl)amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: cyclohexylmethyl-[2-[(3-ethoxycarbonyl-2-thiophenyl)amino]-2-oxoethyl]-methylammonium IUPAC Name: cyclohexylmethyl-[2-[(3-ethoxycarbonylthiophen-2-yl)amino]-2-oxoethyl]-methylazanium Traditional Name: [2-[(3-carbethoxy-2-thienyl)amino]-2-keto-ethyl]-(cyclohexylmethyl)-methyl-ammonium Formula: C17H27N2O3S+ MolecularWeight: 339.47288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1)NC(=O)C[NH+](C)CC2CCCCC2

Isomeric SMILES

CCOC(=O)C1=C(SC=C1)NC(=O)C[NH+](C)CC2CCCCC2

InChI

InChI=1S/C17H26N2O3S/c1-3-22-17(21)14-9-10-23-16(14)18-15(20)12-19(2)11-13-7-5-4-6-8-13/h9-10,13H,3-8,11-12H2,1-2H3,(H,18,20)/p+1