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

Systemtic Name: [2-[[4-(3,4-dimethoxyphenyl)-3-ethoxycarbonyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl]-propan-2-yl-azanium Openeye Name: [2-[[4-(3,4-dimethoxyphenyl)-3-ethoxycarbonyl-2-thienyl]amino]-2-oxo-ethyl]-isopropyl-ammonium CAS Name: [2-[[4-(3,4-dimethoxyphenyl)-3-ethoxycarbonyl-2-thiophenyl]amino]-2-oxoethyl]-propan-2-ylammonium IUPAC Name: [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]-isopropyl-ammonium Formula: C20H27N2O5S+ MolecularWeight: 407.50378

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)OC)OC)NC(=O)C[NH2+]C(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)OC)OC)NC(=O)C[NH2+]C(C)C

InChI

InChI=1S/C20H26N2O5S/c1-6-27-20(24)18-14(13-7-8-15(25-4)16(9-13)26-5)11-28-19(18)22-17(23)10-21-12(2)3/h7-9,11-12,21H,6,10H2,1-5H3,(H,22,23)/p+1