[4-[3-(2-methylphenoxy)propanoylamino]phenyl]methylazanium

Systemtic Name: [4-[3-(2-methylphenoxy)propanoylamino]phenyl]methylazanium Openeye Name: [4-[3-(2-methylphenoxy)propanoylamino]phenyl]methylammonium CAS Name: [4-[[3-(2-methylphenoxy)-1-oxopropyl]amino]phenyl]methylammonium IUPAC Name: [4-[3-(2-methylphenoxy)propanoylamino]phenyl]methylazanium Traditional Name: [4-[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=C(C=C2)C[NH3+]

Isomeric SMILES

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

InChI

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