[4-[2-(azocan-1-yl)-2-oxidanylidene-ethoxy]phenyl]methylazanium

Systemtic Name: [4-[2-(azocan-1-yl)-2-oxidanylidene-ethoxy]phenyl]methylazanium Openeye Name: [4-[2-(azocan-1-yl)-2-oxo-ethoxy]phenyl]methylammonium CAS Name: [4-[2-(1-azocanyl)-2-oxoethoxy]phenyl]methylammonium IUPAC Name: [4-[2-(azocan-1-yl)-2-oxoethoxy]phenyl]methylazanium Traditional Name: [4-[2-(azocan-1-yl)-2-keto-ethoxy]benzyl]ammonium Formula: C16H25N2O2+ MolecularWeight: 277.3819

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=O)COC2=CC=C(C=C2)C[NH3+]

Isomeric SMILES

C1CCCN(CCC1)C(=O)COC2=CC=C(C=C2)C[NH3+]

InChI

InChI=1S/C16H24N2O2/c17-12-14-6-8-15(9-7-14)20-13-16(19)18-10-4-2-1-3-5-11-18/h6-9H,1-5,10-13,17H2/p+1