(2-ethoxycarbonyl-1-benzofuran-3-yl)methyl-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (2-ethoxycarbonyl-1-benzofuran-3-yl)methyl-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (2-ethoxycarbonylbenzofuran-3-yl)methyl-[2-(3-methoxyanilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (2-ethoxycarbonyl-3-benzofuranyl)methyl-[2-(3-methoxyanilino)-2-oxoethyl]-methylammonium IUPAC Name: (2-ethoxycarbonyl-1-benzofuran-3-yl)methyl-[2-(3-methoxyanilino)-2-oxoethyl]-methylazanium Traditional Name: (2-carbethoxybenzofuran-3-yl)methyl-[2-keto-2-(m-anisidino)ethyl]-methyl-ammonium Formula: C22H25N2O5+ MolecularWeight: 397.4443

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)C[NH+](C)CC(=O)NC3=CC(=CC=C3)OC

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)C[NH+](C)CC(=O)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C22H24N2O5/c1-4-28-22(26)21-18(17-10-5-6-11-19(17)29-21)13-24(2)14-20(25)23-15-8-7-9-16(12-15)27-3/h5-12H,4,13-14H2,1-3H3,(H,23,25)/p+1