[4-[[(3-bromophenyl)carbamoyl-(3-methoxypropyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[(3-bromophenyl)carbamoyl-(3-methoxypropyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[(3-bromophenyl)carbamoyl-(3-methoxypropyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[[(3-bromoanilino)-oxomethyl]-(3-methoxypropyl)amino]methyl]phenyl] ester IUPAC Name: [4-[[(3-bromophenyl)carbamoyl-(3-methoxypropyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[(3-bromophenyl)carbamoyl-(3-methoxypropyl)amino]methyl]phenyl] ester Formula: C19H23BrN2O5S MolecularWeight: 471.36532

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN(CC1=CC=C(C=C1)OS(=O)(=O)C)C(=O)NC2=CC(=CC=C2)Br

Isomeric SMILES

COCCCN(CC1=CC=C(C=C1)OS(=O)(=O)C)C(=O)NC2=CC(=CC=C2)Br

InChI

InChI=1S/C19H23BrN2O5S/c1-26-12-4-11-22(19(23)21-17-6-3-5-16(20)13-17)14-15-7-9-18(10-8-15)27-28(2,24)25/h3,5-10,13H,4,11-12,14H2,1-2H3,(H,21,23)