[3-[3-(2-methylphenoxy)propanoylamino]phenyl]methylazanium

Systemtic Name: [3-[3-(2-methylphenoxy)propanoylamino]phenyl]methylazanium Openeye Name: [3-[3-(2-methylphenoxy)propanoylamino]phenyl]methylammonium CAS Name: [3-[[3-(2-methylphenoxy)-1-oxopropyl]amino]phenyl]methylammonium IUPAC Name: [3-[3-(2-methylphenoxy)propanoylamino]phenyl]methylazanium Traditional Name: [3-[3-(2-methylphenoxy)propanoylamino]benzyl]ammonium Formula: C17H21N2O2+ MolecularWeight: 285.36084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCC(=O)NC2=CC=CC(=C2)C[NH3+]

Isomeric SMILES

CC1=CC=CC=C1OCCC(=O)NC2=CC=CC(=C2)C[NH3+]

InChI

InChI=1S/C17H20N2O2/c1-13-5-2-3-8-16(13)21-10-9-17(20)19-15-7-4-6-14(11-15)12-18/h2-8,11H,9-10,12,18H2,1H3,(H,19,20)/p+1