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

Systemtic Name: [3-[3-(2-butoxyethoxy)propanoylamino]phenyl]methylazanium Openeye Name: [3-[3-(2-butoxyethoxy)propanoylamino]phenyl]methylammonium CAS Name: [3-[[3-(2-butoxyethoxy)-1-oxopropyl]amino]phenyl]methylammonium IUPAC Name: [3-[3-(2-butoxyethoxy)propanoylamino]phenyl]methylazanium Traditional Name: [3-[3-(2-butoxyethoxy)propanoylamino]benzyl]ammonium Formula: C16H27N2O3+ MolecularWeight: 295.39718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCOCCC(=O)NC1=CC=CC(=C1)C[NH3+]

Isomeric SMILES

CCCCOCCOCCC(=O)NC1=CC=CC(=C1)C[NH3+]

InChI

InChI=1S/C16H26N2O3/c1-2-3-8-20-10-11-21-9-7-16(19)18-15-6-4-5-14(12-15)13-17/h4-6,12H,2-3,7-11,13,17H2,1H3,(H,18,19)/p+1