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

Systemtic Name: (2-chlorophenyl)methyl-[2-[(3-ethoxycarbonyl-5-phenyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (2-chlorophenyl)methyl-[2-[(3-ethoxycarbonyl-5-phenyl-2-thienyl)amino]-2-oxo-ethyl]ammonium CAS Name: (2-chlorophenyl)methyl-[2-[(3-ethoxycarbonyl-5-phenyl-2-thiophenyl)amino]-2-oxoethyl]ammonium IUPAC Name: (2-chlorophenyl)methyl-[2-[(3-ethoxycarbonyl-5-phenylthiophen-2-yl)amino]-2-oxoethyl]azanium Traditional Name: [2-[(3-carbethoxy-5-phenyl-2-thienyl)amino]-2-keto-ethyl]-(2-chlorobenzyl)ammonium Formula: C22H22ClN2O3S+ MolecularWeight: 429.93968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C[NH2+]CC3=CC=CC=C3Cl

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C[NH2+]CC3=CC=CC=C3Cl

InChI

InChI=1S/C22H21ClN2O3S/c1-2-28-22(27)17-12-19(15-8-4-3-5-9-15)29-21(17)25-20(26)14-24-13-16-10-6-7-11-18(16)23/h3-12,24H,2,13-14H2,1H3,(H,25,26)/p+1