[4-[[butyl(naphthalen-2-ylcarbonyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[butyl(naphthalen-2-ylcarbonyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[butyl(naphthalene-2-carbonyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[butyl-[2-naphthalenyl(oxo)methyl]amino]methyl]phenyl] ester IUPAC Name: [4-[[butyl(naphthalene-2-carbonyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[butyl(2-naphthoyl)amino]methyl]phenyl] ester Formula: C23H25NO4S MolecularWeight: 411.5139

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=C(C=C1)OS(=O)(=O)C)C(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CCCCN(CC1=CC=C(C=C1)OS(=O)(=O)C)C(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C23H25NO4S/c1-3-4-15-24(17-18-9-13-22(14-10-18)28-29(2,26)27)23(25)21-12-11-19-7-5-6-8-20(19)16-21/h5-14,16H,3-4,15,17H2,1-2H3