[4-[[3-methoxypropyl-(4-phenylphenyl)carbonyl-amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[3-methoxypropyl-(4-phenylphenyl)carbonyl-amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[3-methoxypropyl-(4-phenylbenzoyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[3-methoxypropyl-[oxo-(4-phenylphenyl)methyl]amino]methyl]phenyl] ester IUPAC Name: [4-[[3-methoxypropyl-(4-phenylbenzoyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[3-methoxypropyl-(4-phenylbenzoyl)amino]methyl]phenyl] ester Formula: C25H27NO5S MolecularWeight: 453.55058

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN(CC1=CC=C(C=C1)OS(=O)(=O)C)C(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

COCCCN(CC1=CC=C(C=C1)OS(=O)(=O)C)C(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H27NO5S/c1-30-18-6-17-26(19-20-9-15-24(16-10-20)31-32(2,28)29)25(27)23-13-11-22(12-14-23)21-7-4-3-5-8-21/h3-5,7-16H,6,17-19H2,1-2H3