methyl-[[4-[2-(2-methylpropanoylamino)ethoxy]phenyl]methyl]-(naphthalen-1-ylmethyl)azanium

Systemtic Name: methyl-[[4-[2-(2-methylpropanoylamino)ethoxy]phenyl]methyl]-(naphthalen-1-ylmethyl)azanium Openeye Name: methyl-[[4-[2-(2-methylpropanoylamino)ethoxy]phenyl]methyl]-(1-naphthylmethyl)ammonium CAS Name: methyl-[[4-[2-[(2-methyl-1-oxopropyl)amino]ethoxy]phenyl]methyl]-(1-naphthalenylmethyl)ammonium IUPAC Name: methyl-[[4-[2-(2-methylpropanoylamino)ethoxy]phenyl]methyl]-(naphthalen-1-ylmethyl)azanium Traditional Name: [4-[2-(isobutyrylamino)ethoxy]benzyl]-methyl-(1-naphthylmethyl)ammonium Formula: C25H31N2O2+ MolecularWeight: 391.52584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCOC1=CC=C(C=C1)C[NH+](C)CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC(C)C(=O)NCCOC1=CC=C(C=C1)C[NH+](C)CC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C25H30N2O2/c1-19(2)25(28)26-15-16-29-23-13-11-20(12-14-23)17-27(3)18-22-9-6-8-21-7-4-5-10-24(21)22/h4-14,19H,15-18H2,1-3H3,(H,26,28)/p+1