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

Systemtic Name: [4-[[butyl(pentanoyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[butyl(pentanoyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[butyl(1-oxopentyl)amino]methyl]phenyl] ester IUPAC Name: [4-[[butyl(pentanoyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[butyl(valeryl)amino]methyl]phenyl] ester Formula: C17H27NO4S MolecularWeight: 341.46558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27NO4S/c1-4-6-8-17(19)18(13-7-5-2)14-15-9-11-16(12-10-15)22-23(3,20)21/h9-12H,4-8,13-14H2,1-3H3