[4-[2-(tert-butylamino)-2-oxidanylidene-ethoxy]phenyl]methyl-[(2R)-1-oxidanylbutan-2-yl]azanium

Systemtic Name: [4-[2-(tert-butylamino)-2-oxidanylidene-ethoxy]phenyl]methyl-[(2R)-1-oxidanylbutan-2-yl]azanium Openeye Name: [4-[2-(tert-butylamino)-2-oxo-ethoxy]phenyl]methyl-[(1R)-1-(hydroxymethyl)propyl]ammonium CAS Name: [4-[2-(tert-butylamino)-2-oxoethoxy]phenyl]methyl-[(2R)-1-hydroxybutan-2-yl]ammonium IUPAC Name: [4-[2-(tert-butylamino)-2-oxoethoxy]phenyl]methyl-[(2R)-1-hydroxybutan-2-yl]azanium Traditional Name: [4-[2-(tert-butylamino)-2-keto-ethoxy]benzyl]-[(1R)-1-methylolpropyl]ammonium Formula: C17H29N2O3+ MolecularWeight: 309.42376

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@H](CO)[NH2+]CC1=CC=C(C=C1)OCC(=O)NC(C)(C)C

InChI

InChI=1S/C17H28N2O3/c1-5-14(11-20)18-10-13-6-8-15(9-7-13)22-12-16(21)19-17(2,3)4/h6-9,14,18,20H,5,10-12H2,1-4H3,(H,19,21)/p+1/t14-/m1/s1