[2-[(3-ethoxycarbonyl-5-ethyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-phenethyl-azanium

Systemtic Name: [2-[(3-ethoxycarbonyl-5-ethyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-phenethyl-azanium Openeye Name: [2-[(3-ethoxycarbonyl-5-ethyl-2-thienyl)amino]-2-oxo-ethyl]-phenethyl-ammonium CAS Name: [2-[(3-ethoxycarbonyl-5-ethyl-2-thiophenyl)amino]-2-oxoethyl]-phenethylammonium IUPAC Name: [2-[(3-ethoxycarbonyl-5-ethylthiophen-2-yl)amino]-2-oxoethyl]-phenethylazanium Traditional Name: [2-[(3-carbethoxy-5-ethyl-2-thienyl)amino]-2-keto-ethyl]-phenethyl-ammonium Formula: C19H25N2O3S+ MolecularWeight: 361.4784

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C[NH2+]CCC2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C[NH2+]CCC2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C19H24N2O3S/c1-3-15-12-16(19(23)24-4-2)18(25-15)21-17(22)13-20-11-10-14-8-6-5-7-9-14/h5-9,12,20H,3-4,10-11,13H2,1-2H3,(H,21,22)/p+1