[2-[(4-ethoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-(thiophen-3-ylmethyl)azanium

Systemtic Name: [2-[(4-ethoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-(thiophen-3-ylmethyl)azanium Openeye Name: [2-(4-ethoxycarbonylanilino)-2-oxo-ethyl]-methyl-(3-thienylmethyl)ammonium CAS Name: [2-(4-ethoxycarbonylanilino)-2-oxoethyl]-methyl-(3-thiophenylmethyl)ammonium IUPAC Name: [2-(4-ethoxycarbonylanilino)-2-oxoethyl]-methyl-(thiophen-3-ylmethyl)azanium Traditional Name: [2-(4-carbethoxyanilino)-2-keto-ethyl]-methyl-(3-thenyl)ammonium Formula: C17H21N2O3S+ MolecularWeight: 333.42524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C[NH+](C)CC2=CSC=C2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C[NH+](C)CC2=CSC=C2

InChI

InChI=1S/C17H20N2O3S/c1-3-22-17(21)14-4-6-15(7-5-14)18-16(20)11-19(2)10-13-8-9-23-12-13/h4-9,12H,3,10-11H2,1-2H3,(H,18,20)/p+1