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

Systemtic Name: [4-[[cyclopropyl-[(2-methoxyphenyl)carbamoyl]amino]methyl]phenyl] ethanesulfonate Openeye Name: [4-[[cyclopropyl-[(2-methoxyphenyl)carbamoyl]amino]methyl]phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [4-[[cyclopropyl-[(2-methoxyanilino)-oxomethyl]amino]methyl]phenyl] ester IUPAC Name: [4-[[cyclopropyl-[(2-methoxyphenyl)carbamoyl]amino]methyl]phenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [4-[[cyclopropyl-[(2-methoxyphenyl)carbamoyl]amino]methyl]phenyl] ester Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=CC=C(C=C1)CN(C2CC2)C(=O)NC3=CC=CC=C3OC

Isomeric SMILES

CCS(=O)(=O)OC1=CC=C(C=C1)CN(C2CC2)C(=O)NC3=CC=CC=C3OC

InChI

InChI=1S/C20H24N2O5S/c1-3-28(24,25)27-17-12-8-15(9-13-17)14-22(16-10-11-16)20(23)21-18-6-4-5-7-19(18)26-2/h4-9,12-13,16H,3,10-11,14H2,1-2H3,(H,21,23)