[5-[[2-dimethylaminoethyl(furan-2-ylcarbonyl)amino]methyl]-2-methoxy-phenyl] 4-methoxybenzenesulfonate

Systemtic Name: [5-[[2-dimethylaminoethyl(furan-2-ylcarbonyl)amino]methyl]-2-methoxy-phenyl] 4-methoxybenzenesulfonate Openeye Name: [5-[[2-dimethylaminoethyl(furan-2-carbonyl)amino]methyl]-2-methoxy-phenyl] 4-methoxybenzenesulfonate CAS Name: 4-methoxybenzenesulfonic acid [5-[[2-dimethylaminoethyl-[2-furanyl(oxo)methyl]amino]methyl]-2-methoxyphenyl] ester IUPAC Name: [5-[[2-dimethylaminoethyl(furan-2-carbonyl)amino]methyl]-2-methoxyphenyl] 4-methoxybenzenesulfonate Traditional Name: 4-methoxybenzenesulfonic acid [5-[[2-dimethylaminoethyl(2-furoyl)amino]methyl]-2-methoxy-phenyl] ester Formula: C24H28N2O7S MolecularWeight: 488.55332

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(CC1=CC(=C(C=C1)OC)OS(=O)(=O)C2=CC=C(C=C2)OC)C(=O)C3=CC=CO3

Isomeric SMILES

CN(C)CCN(CC1=CC(=C(C=C1)OC)OS(=O)(=O)C2=CC=C(C=C2)OC)C(=O)C3=CC=CO3

InChI

InChI=1S/C24H28N2O7S/c1-25(2)13-14-26(24(27)22-6-5-15-32-22)17-18-7-12-21(31-4)23(16-18)33-34(28,29)20-10-8-19(30-3)9-11-20/h5-12,15-16H,13-14,17H2,1-4H3