(2,3-dimethoxyphenyl)methyl-[2-[(3-ethoxycarbonyl-4-methyl-5-prop-2-enoxycarbonyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (2,3-dimethoxyphenyl)methyl-[2-[(3-ethoxycarbonyl-4-methyl-5-prop-2-enoxycarbonyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [2-[(5-allyloxycarbonyl-3-ethoxycarbonyl-4-methyl-2-thienyl)amino]-2-oxo-ethyl]-[(2,3-dimethoxyphenyl)methyl]-methyl-ammonium CAS Name: (2,3-dimethoxyphenyl)methyl-[2-[[3-ethoxycarbonyl-4-methyl-5-[oxo(prop-2-enoxy)methyl]-2-thiophenyl]amino]-2-oxoethyl]-methylammonium IUPAC Name: (2,3-dimethoxyphenyl)methyl-[2-[(3-ethoxycarbonyl-4-methyl-5-prop-2-enoxycarbonylthiophen-2-yl)amino]-2-oxoethyl]-methylazanium Traditional Name: [2-[(5-allyloxycarbonyl-3-carbethoxy-4-methyl-2-thienyl)amino]-2-keto-ethyl]-methyl-o-veratryl-ammonium Formula: C24H31N2O7S+ MolecularWeight: 491.57714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC=C)NC(=O)C[NH+](C)CC2=C(C(=CC=C2)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC=C)NC(=O)C[NH+](C)CC2=C(C(=CC=C2)OC)OC

InChI

InChI=1S/C24H30N2O7S/c1-7-12-33-24(29)21-15(3)19(23(28)32-8-2)22(34-21)25-18(27)14-26(4)13-16-10-9-11-17(30-5)20(16)31-6/h7,9-11H,1,8,12-14H2,2-6H3,(H,25,27)/p+1