[4-[2-(tert-butylamino)-2-oxidanylidene-ethoxy]phenyl]methyl-pentyl-azanium

Systemtic Name: [4-[2-(tert-butylamino)-2-oxidanylidene-ethoxy]phenyl]methyl-pentyl-azanium Openeye Name: [4-[2-(tert-butylamino)-2-oxo-ethoxy]phenyl]methyl-pentyl-ammonium CAS Name: [4-[2-(tert-butylamino)-2-oxoethoxy]phenyl]methyl-pentylammonium IUPAC Name: [4-[2-(tert-butylamino)-2-oxoethoxy]phenyl]methyl-pentylazanium Traditional Name: amyl-[4-[2-(tert-butylamino)-2-keto-ethoxy]benzyl]ammonium Formula: C18H31N2O2+ MolecularWeight: 307.45094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[NH2+]CC1=CC=C(C=C1)OCC(=O)NC(C)(C)C

Isomeric SMILES

CCCCC[NH2+]CC1=CC=C(C=C1)OCC(=O)NC(C)(C)C

InChI

InChI=1S/C18H30N2O2/c1-5-6-7-12-19-13-15-8-10-16(11-9-15)22-14-17(21)20-18(2,3)4/h8-11,19H,5-7,12-14H2,1-4H3,(H,20,21)/p+1