3-[4-[(2R)-butan-2-yl]phenoxy]propyl-butyl-azanium

Systemtic Name: 3-[4-[(2R)-butan-2-yl]phenoxy]propyl-butyl-azanium Openeye Name: butyl-[3-[4-[(1R)-1-methylpropyl]phenoxy]propyl]ammonium CAS Name: 3-[4-[(2R)-butan-2-yl]phenoxy]propyl-butylammonium IUPAC Name: 3-[4-[(2R)-butan-2-yl]phenoxy]propyl-butylazanium Traditional Name: butyl-[3-[4-[(1R)-1-methylpropyl]phenoxy]propyl]ammonium Formula: C17H30NO+ MolecularWeight: 264.4262

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH2+]CCCOC1=CC=C(C=C1)C(C)CC

Isomeric SMILES

CCCC[NH2+]CCCOC1=CC=C(C=C1)[C@H](C)CC

InChI

InChI=1S/C17H29NO/c1-4-6-12-18-13-7-14-19-17-10-8-16(9-11-17)15(3)5-2/h8-11,15,18H,4-7,12-14H2,1-3H3/p+1/t15-/m1/s1