[2-[(4-methoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl]-bis(thiophen-2-ylmethyl)azanium

Systemtic Name: [2-[(4-methoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl]-bis(thiophen-2-ylmethyl)azanium Openeye Name: [2-(4-methoxycarbonylanilino)-2-oxo-ethyl]-bis(2-thienylmethyl)ammonium CAS Name: [2-(4-methoxycarbonylanilino)-2-oxoethyl]-bis(thiophen-2-ylmethyl)ammonium IUPAC Name: [2-(4-methoxycarbonylanilino)-2-oxoethyl]-bis(thiophen-2-ylmethyl)azanium Traditional Name: [2-(4-carbomethoxyanilino)-2-keto-ethyl]-bis(2-thenyl)ammonium Formula: C20H21N2O3S2+ MolecularWeight: 401.52234

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C[NH+](CC2=CC=CS2)CC3=CC=CS3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C[NH+](CC2=CC=CS2)CC3=CC=CS3

InChI

InChI=1S/C20H20N2O3S2/c1-25-20(24)15-6-8-16(9-7-15)21-19(23)14-22(12-17-4-2-10-26-17)13-18-5-3-11-27-18/h2-11H,12-14H2,1H3,(H,21,23)/p+1