1-[4-(4-propan-2-yloxyphenoxy)butyl]azepan-1-ium

Systemtic Name: 1-[4-(4-propan-2-yloxyphenoxy)butyl]azepan-1-ium Openeye Name: 1-[4-(4-isopropoxyphenoxy)butyl]azepan-1-ium CAS Name: 1-[4-(4-propan-2-yloxyphenoxy)butyl]azepan-1-ium IUPAC Name: 1-[4-(4-propan-2-yloxyphenoxy)butyl]azepan-1-ium Traditional Name: 1-[4-(4-isopropoxyphenoxy)butyl]azepan-1-ium Formula: C19H32NO2+ MolecularWeight: 306.46288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)OCCCC[NH+]2CCCCCC2

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)OCCCC[NH+]2CCCCCC2

InChI

InChI=1S/C19H31NO2/c1-17(2)22-19-11-9-18(10-12-19)21-16-8-7-15-20-13-5-3-4-6-14-20/h9-12,17H,3-8,13-16H2,1-2H3/p+1