[4-[[2-methoxyethyl(naphthalen-1-ylcarbamoyl)amino]methyl]phenyl] ethanesulfonate

Systemtic Name: [4-[[2-methoxyethyl(naphthalen-1-ylcarbamoyl)amino]methyl]phenyl] ethanesulfonate Openeye Name: [4-[[2-methoxyethyl(1-naphthylcarbamoyl)amino]methyl]phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [4-[[2-methoxyethyl-[(1-naphthalenylamino)-oxomethyl]amino]methyl]phenyl] ester IUPAC Name: [4-[[2-methoxyethyl(naphthalen-1-ylcarbamoyl)amino]methyl]phenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [4-[[2-methoxyethyl(1-naphthylcarbamoyl)amino]methyl]phenyl] ester Formula: C23H26N2O5S MolecularWeight: 442.52794

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=CC=C(C=C1)CN(CCOC)C(=O)NC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CCS(=O)(=O)OC1=CC=C(C=C1)CN(CCOC)C(=O)NC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C23H26N2O5S/c1-3-31(27,28)30-20-13-11-18(12-14-20)17-25(15-16-29-2)23(26)24-22-10-6-8-19-7-4-5-9-21(19)22/h4-14H,3,15-17H2,1-2H3,(H,24,26)