[4-[[butyl(butylcarbamoyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[butyl(butylcarbamoyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[butyl(butylcarbamoyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[butyl-[butylamino(oxo)methyl]amino]methyl]phenyl] ester IUPAC Name: [4-[[butyl(butylcarbamoyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[butyl(butylcarbamoyl)amino]methyl]phenyl] ester Formula: C17H28N2O4S MolecularWeight: 356.48022

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N(CCCC)CC1=CC=C(C=C1)OS(=O)(=O)C

Isomeric SMILES

CCCCNC(=O)N(CCCC)CC1=CC=C(C=C1)OS(=O)(=O)C

InChI

InChI=1S/C17H28N2O4S/c1-4-6-12-18-17(20)19(13-7-5-2)14-15-8-10-16(11-9-15)23-24(3,21)22/h8-11H,4-7,12-14H2,1-3H3,(H,18,20)