[2-[[4-(2-chlorophenyl)-3-ethoxycarbonyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl]-propyl-azanium

Systemtic Name: [2-[[4-(2-chlorophenyl)-3-ethoxycarbonyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl]-propyl-azanium Openeye Name: [2-[[4-(2-chlorophenyl)-3-ethoxycarbonyl-2-thienyl]amino]-2-oxo-ethyl]-propyl-ammonium CAS Name: [2-[[4-(2-chlorophenyl)-3-ethoxycarbonyl-2-thiophenyl]amino]-2-oxoethyl]-propylammonium IUPAC Name: [2-[[4-(2-chlorophenyl)-3-ethoxycarbonylthiophen-2-yl]amino]-2-oxoethyl]-propylazanium Traditional Name: [2-[[3-carbethoxy-4-(2-chlorophenyl)-2-thienyl]amino]-2-keto-ethyl]-propyl-ammonium Formula: C18H22ClN2O3S+ MolecularWeight: 381.89688

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]CC(=O)NC1=C(C(=CS1)C2=CC=CC=C2Cl)C(=O)OCC

Isomeric SMILES

CCC[NH2+]CC(=O)NC1=C(C(=CS1)C2=CC=CC=C2Cl)C(=O)OCC

InChI

InChI=1S/C18H21ClN2O3S/c1-3-9-20-10-15(22)21-17-16(18(23)24-4-2)13(11-25-17)12-7-5-6-8-14(12)19/h5-8,11,20H,3-4,9-10H2,1-2H3,(H,21,22)/p+1