cyclopropyl-[2-[(3-ethoxycarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl]-[(4-methoxyphenyl)methyl]azanium

Systemtic Name: cyclopropyl-[2-[(3-ethoxycarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl]-[(4-methoxyphenyl)methyl]azanium Openeye Name: cyclopropyl-[2-[(3-ethoxycarbonyl-2-thienyl)amino]-2-oxo-ethyl]-[(4-methoxyphenyl)methyl]ammonium CAS Name: cyclopropyl-[2-[(3-ethoxycarbonyl-2-thiophenyl)amino]-2-oxoethyl]-[(4-methoxyphenyl)methyl]ammonium IUPAC Name: cyclopropyl-[2-[(3-ethoxycarbonylthiophen-2-yl)amino]-2-oxoethyl]-[(4-methoxyphenyl)methyl]azanium Traditional Name: [2-[(3-carbethoxy-2-thienyl)amino]-2-keto-ethyl]-cyclopropyl-p-anisyl-ammonium Formula: C20H25N2O4S+ MolecularWeight: 389.4885

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1)NC(=O)C[NH+](CC2=CC=C(C=C2)OC)C3CC3

Isomeric SMILES

CCOC(=O)C1=C(SC=C1)NC(=O)C[NH+](CC2=CC=C(C=C2)OC)C3CC3

InChI

InChI=1S/C20H24N2O4S/c1-3-26-20(24)17-10-11-27-19(17)21-18(23)13-22(15-6-7-15)12-14-4-8-16(25-2)9-5-14/h4-5,8-11,15H,3,6-7,12-13H2,1-2H3,(H,21,23)/p+1