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

Systemtic Name: [3-[[furan-2-ylmethyl(naphthalen-1-ylcarbamoyl)amino]methyl]phenyl] ethanesulfonate Openeye Name: [3-[[2-furylmethyl(1-naphthylcarbamoyl)amino]methyl]phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [3-[[2-furanylmethyl-[(1-naphthalenylamino)-oxomethyl]amino]methyl]phenyl] ester IUPAC Name: [3-[[furan-2-ylmethyl(naphthalen-1-ylcarbamoyl)amino]methyl]phenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [3-[[2-furfuryl(1-naphthylcarbamoyl)amino]methyl]phenyl] ester Formula: C25H24N2O5S MolecularWeight: 464.53346

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=CC=CC(=C1)CN(CC2=CC=CO2)C(=O)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCS(=O)(=O)OC1=CC=CC(=C1)CN(CC2=CC=CO2)C(=O)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H24N2O5S/c1-2-33(29,30)32-21-11-5-8-19(16-21)17-27(18-22-12-7-15-31-22)25(28)26-24-14-6-10-20-9-3-4-13-23(20)24/h3-16H,2,17-18H2,1H3,(H,26,28)