dibutyl-[2-[(3-ethoxycarbonyl-4-phenyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: dibutyl-[2-[(3-ethoxycarbonyl-4-phenyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: dibutyl-[2-[(3-ethoxycarbonyl-4-phenyl-2-thienyl)amino]-2-oxo-ethyl]ammonium CAS Name: dibutyl-[2-[(3-ethoxycarbonyl-4-phenyl-2-thiophenyl)amino]-2-oxoethyl]ammonium IUPAC Name: dibutyl-[2-[(3-ethoxycarbonyl-4-phenylthiophen-2-yl)amino]-2-oxoethyl]azanium Traditional Name: dibutyl-[2-[(3-carbethoxy-4-phenyl-2-thienyl)amino]-2-keto-ethyl]ammonium Formula: C23H33N2O3S+ MolecularWeight: 417.58472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)CC(=O)NC1=C(C(=CS1)C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCCC[NH+](CCCC)CC(=O)NC1=C(C(=CS1)C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C23H32N2O3S/c1-4-7-14-25(15-8-5-2)16-20(26)24-22-21(23(27)28-6-3)19(17-29-22)18-12-10-9-11-13-18/h9-13,17H,4-8,14-16H2,1-3H3,(H,24,26)/p+1