[3-[[furan-2-ylmethyl(pentanoyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [3-[[furan-2-ylmethyl(pentanoyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [3-[[2-furylmethyl(pentanoyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-[[2-furanylmethyl(1-oxopentyl)amino]methyl]phenyl] ester IUPAC Name: [3-[[furan-2-ylmethyl(pentanoyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [3-[[2-furfuryl(valeryl)amino]methyl]phenyl] ester Formula: C18H23NO5S MolecularWeight: 365.44392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N(CC1=CC(=CC=C1)OS(=O)(=O)C)CC2=CC=CO2

Isomeric SMILES

CCCCC(=O)N(CC1=CC(=CC=C1)OS(=O)(=O)C)CC2=CC=CO2

InChI

InChI=1S/C18H23NO5S/c1-3-4-10-18(20)19(14-17-9-6-11-23-17)13-15-7-5-8-16(12-15)24-25(2,21)22/h5-9,11-12H,3-4,10,13-14H2,1-2H3