[3-[[furan-2-ylmethyl(naphthalen-1-ylcarbonyl)amino]methyl]phenyl] ethanesulfonate

Systemtic Name: [3-[[furan-2-ylmethyl(naphthalen-1-ylcarbonyl)amino]methyl]phenyl] ethanesulfonate Openeye Name: [3-[[2-furylmethyl(naphthalene-1-carbonyl)amino]methyl]phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [3-[[2-furanylmethyl-[1-naphthalenyl(oxo)methyl]amino]methyl]phenyl] ester IUPAC Name: [3-[[furan-2-ylmethyl(naphthalene-1-carbonyl)amino]methyl]phenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [3-[[2-furfuryl(1-naphthoyl)amino]methyl]phenyl] ester Formula: C25H23NO5S MolecularWeight: 449.51882

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=CC=CC(=C1)CN(CC2=CC=CO2)C(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCS(=O)(=O)OC1=CC=CC(=C1)CN(CC2=CC=CO2)C(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H23NO5S/c1-2-32(28,29)31-21-11-5-8-19(16-21)17-26(18-22-12-7-15-30-22)25(27)24-14-6-10-20-9-3-4-13-23(20)24/h3-16H,2,17-18H2,1H3