[5-[[cyclopropyl-[(2-methoxyphenyl)carbamoyl]amino]methyl]-2-methoxy-phenyl] methanesulfonate

Systemtic Name: [5-[[cyclopropyl-[(2-methoxyphenyl)carbamoyl]amino]methyl]-2-methoxy-phenyl] methanesulfonate Openeye Name: [5-[[cyclopropyl-[(2-methoxyphenyl)carbamoyl]amino]methyl]-2-methoxy-phenyl] methanesulfonate CAS Name: methanesulfonic acid [5-[[cyclopropyl-[(2-methoxyanilino)-oxomethyl]amino]methyl]-2-methoxyphenyl] ester IUPAC Name: [5-[[cyclopropyl-[(2-methoxyphenyl)carbamoyl]amino]methyl]-2-methoxyphenyl] methanesulfonate Traditional Name: methanesulfonic acid [5-[[cyclopropyl-[(2-methoxyphenyl)carbamoyl]amino]methyl]-2-methoxy-phenyl] ester Formula: C20H24N2O6S MolecularWeight: 420.47936

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(C2CC2)C(=O)NC3=CC=CC=C3OC)OS(=O)(=O)C

Isomeric SMILES

COC1=C(C=C(C=C1)CN(C2CC2)C(=O)NC3=CC=CC=C3OC)OS(=O)(=O)C

InChI

InChI=1S/C20H24N2O6S/c1-26-17-7-5-4-6-16(17)21-20(23)22(15-9-10-15)13-14-8-11-18(27-2)19(12-14)28-29(3,24)25/h4-8,11-12,15H,9-10,13H2,1-3H3,(H,21,23)