(3-chlorophenyl)methyl-[2-[(3-ethoxycarbonyl-4,5-dimethyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (3-chlorophenyl)methyl-[2-[(3-ethoxycarbonyl-4,5-dimethyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (3-chlorophenyl)methyl-[2-[(3-ethoxycarbonyl-4,5-dimethyl-2-thienyl)amino]-2-oxo-ethyl]ammonium CAS Name: (3-chlorophenyl)methyl-[2-[(3-ethoxycarbonyl-4,5-dimethyl-2-thiophenyl)amino]-2-oxoethyl]ammonium IUPAC Name: (3-chlorophenyl)methyl-[2-[(3-ethoxycarbonyl-4,5-dimethylthiophen-2-yl)amino]-2-oxoethyl]azanium Traditional Name: [2-[(3-carbethoxy-4,5-dimethyl-2-thienyl)amino]-2-keto-ethyl]-(3-chlorobenzyl)ammonium Formula: C18H22ClN2O3S+ MolecularWeight: 381.89688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C[NH2+]CC2=CC(=CC=C2)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C[NH2+]CC2=CC(=CC=C2)Cl

InChI

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