tert-butyl-[2-[[3-ethoxycarbonyl-4-(4-methoxyphenyl)thiophen-2-yl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: tert-butyl-[2-[[3-ethoxycarbonyl-4-(4-methoxyphenyl)thiophen-2-yl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: tert-butyl-[2-[[3-ethoxycarbonyl-4-(4-methoxyphenyl)-2-thienyl]amino]-2-oxo-ethyl]ammonium CAS Name: tert-butyl-[2-[[3-ethoxycarbonyl-4-(4-methoxyphenyl)-2-thiophenyl]amino]-2-oxoethyl]ammonium IUPAC Name: tert-butyl-[2-[[3-ethoxycarbonyl-4-(4-methoxyphenyl)thiophen-2-yl]amino]-2-oxoethyl]azanium Traditional Name: tert-butyl-[2-[[3-carbethoxy-4-(4-methoxyphenyl)-2-thienyl]amino]-2-keto-ethyl]ammonium Formula: C20H27N2O4S+ MolecularWeight: 391.50438

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)OC)NC(=O)C[NH2+]C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)OC)NC(=O)C[NH2+]C(C)(C)C

InChI

InChI=1S/C20H26N2O4S/c1-6-26-19(24)17-15(13-7-9-14(25-5)10-8-13)12-27-18(17)22-16(23)11-21-20(2,3)4/h7-10,12,21H,6,11H2,1-5H3,(H,22,23)/p+1