cyclopropyl-[2-[[4-(3,4-dimethoxyphenyl)-3-ethoxycarbonyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl]-propan-2-yl-azanium

Systemtic Name: cyclopropyl-[2-[[4-(3,4-dimethoxyphenyl)-3-ethoxycarbonyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl]-propan-2-yl-azanium Openeye Name: cyclopropyl-[2-[[4-(3,4-dimethoxyphenyl)-3-ethoxycarbonyl-2-thienyl]amino]-2-oxo-ethyl]-isopropyl-ammonium CAS Name: cyclopropyl-[2-[[4-(3,4-dimethoxyphenyl)-3-ethoxycarbonyl-2-thiophenyl]amino]-2-oxoethyl]-propan-2-ylammonium IUPAC Name: cyclopropyl-[2-[[4-(3,4-dimethoxyphenyl)-3-ethoxycarbonylthiophen-2-yl]amino]-2-oxoethyl]-propan-2-ylazanium Traditional Name: [2-[[3-carbethoxy-4-(3,4-dimethoxyphenyl)-2-thienyl]amino]-2-keto-ethyl]-cyclopropyl-isopropyl-ammonium Formula: C23H31N2O5S+ MolecularWeight: 447.56764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)OC)OC)NC(=O)C[NH+](C3CC3)C(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)OC)OC)NC(=O)C[NH+](C3CC3)C(C)C

InChI

InChI=1S/C23H30N2O5S/c1-6-30-23(27)21-17(15-7-10-18(28-4)19(11-15)29-5)13-31-22(21)24-20(26)12-25(14(2)3)16-8-9-16/h7,10-11,13-14,16H,6,8-9,12H2,1-5H3,(H,24,26)/p+1