4-oxidanylbut-2-ynyl-(phenylmethyl)-propan-2-yl-azanium

Systemtic Name: 4-oxidanylbut-2-ynyl-(phenylmethyl)-propan-2-yl-azanium Openeye Name: benzyl-(4-hydroxybut-2-ynyl)-isopropyl-ammonium CAS Name: 4-hydroxybut-2-ynyl-(phenylmethyl)-propan-2-ylammonium IUPAC Name: benzyl-(4-hydroxybut-2-ynyl)-propan-2-ylazanium Traditional Name: benzyl-(4-hydroxybut-2-ynyl)-isopropyl-ammonium Formula: C14H20NO+ MolecularWeight: 218.3147

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CC#CCO)CC1=CC=CC=C1

Isomeric SMILES

CC(C)[NH+](CC#CCO)CC1=CC=CC=C1

InChI

InChI=1S/C14H19NO/c1-13(2)15(10-6-7-11-16)12-14-8-4-3-5-9-14/h3-5,8-9,13,16H,10-12H2,1-2H3/p+1