methanesulfonic acid; 3-oxidanyl-2-[[4-(3-phenylpropoxy)phenyl]methylamino]propanamide

Systemtic Name: methanesulfonic acid; 3-oxidanyl-2-[[4-(3-phenylpropoxy)phenyl]methylamino]propanamide Openeye Name: 3-hydroxy-2-[[4-(3-phenylpropoxy)phenyl]methylamino]propanamide; methanesulfonic acid CAS Name: 3-hydroxy-2-[[4-(3-phenylpropoxy)phenyl]methylamino]propanamide; methanesulfonic acid IUPAC Name: 3-hydroxy-2-[[4-(3-phenylpropoxy)phenyl]methylamino]propanamide; methanesulfonic acid Traditional Name: 3-hydroxy-2-[[4-(3-phenylpropoxy)benzyl]amino]propionamide; mesylic acid Formula: C20H28N2O6S MolecularWeight: 424.51112

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)O.C1=CC=C(C=C1)CCCOC2=CC=C(C=C2)CNC(CO)C(=O)N

Isomeric SMILES

CS(=O)(=O)O.C1=CC=C(C=C1)CCCOC2=CC=C(C=C2)CNC(CO)C(=O)N

InChI

InChI=1S/C19H24N2O3.CH4O3S/c20-19(23)18(14-22)21-13-16-8-10-17(11-9-16)24-12-4-7-15-5-2-1-3-6-15;1-5(2,3)4/h1-3,5-6,8-11,18,21-22H,4,7,12-14H2,(H2,20,23);1H3,(H,2,3,4)