[4-[[cyclopropyl-[(2-methoxyphenyl)carbamoyl]amino]methyl]phenyl] 4-methoxybenzenesulfonate

Systemtic Name: [4-[[cyclopropyl-[(2-methoxyphenyl)carbamoyl]amino]methyl]phenyl] 4-methoxybenzenesulfonate Openeye Name: [4-[[cyclopropyl-[(2-methoxyphenyl)carbamoyl]amino]methyl]phenyl] 4-methoxybenzenesulfonate CAS Name: 4-methoxybenzenesulfonic acid [4-[[cyclopropyl-[(2-methoxyanilino)-oxomethyl]amino]methyl]phenyl] ester IUPAC Name: [4-[[cyclopropyl-[(2-methoxyphenyl)carbamoyl]amino]methyl]phenyl] 4-methoxybenzenesulfonate Traditional Name: 4-methoxybenzenesulfonic acid [4-[[cyclopropyl-[(2-methoxyphenyl)carbamoyl]amino]methyl]phenyl] ester Formula: C25H26N2O6S MolecularWeight: 482.54874

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)CN(C3CC3)C(=O)NC4=CC=CC=C4OC

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)CN(C3CC3)C(=O)NC4=CC=CC=C4OC

InChI

InChI=1S/C25H26N2O6S/c1-31-20-13-15-22(16-14-20)34(29,30)33-21-11-7-18(8-12-21)17-27(19-9-10-19)25(28)26-23-5-3-4-6-24(23)32-2/h3-8,11-16,19H,9-10,17H2,1-2H3,(H,26,28)