(5-chloranylthiophen-2-yl)methyl-methyl-[2-oxidanylidene-2-[(4-propan-2-yloxycarbonylphenyl)amino]ethyl]azanium

Systemtic Name: (5-chloranylthiophen-2-yl)methyl-methyl-[2-oxidanylidene-2-[(4-propan-2-yloxycarbonylphenyl)amino]ethyl]azanium Openeye Name: (5-chloro-2-thienyl)methyl-[2-(4-isopropoxycarbonylanilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (5-chloro-2-thiophenyl)methyl-methyl-[2-oxo-2-[4-[oxo(propan-2-yloxy)methyl]anilino]ethyl]ammonium IUPAC Name: (5-chlorothiophen-2-yl)methyl-methyl-[2-oxo-2-(4-propan-2-yloxycarbonylanilino)ethyl]azanium Traditional Name: (5-chloro-2-thienyl)methyl-[2-(4-isopropoxycarbonylanilino)-2-keto-ethyl]-methyl-ammonium Formula: C18H22ClN2O3S+ MolecularWeight: 381.89688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)C[NH+](C)CC2=CC=C(S2)Cl

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)C[NH+](C)CC2=CC=C(S2)Cl

InChI

InChI=1S/C18H21ClN2O3S/c1-12(2)24-18(23)13-4-6-14(7-5-13)20-17(22)11-21(3)10-15-8-9-16(19)25-15/h4-9,12H,10-11H2,1-3H3,(H,20,22)/p+1