4-(4-chloranyl-2-prop-2-enyl-phenoxy)butyl-diethyl-azanium

Systemtic Name: 4-(4-chloranyl-2-prop-2-enyl-phenoxy)butyl-diethyl-azanium Openeye Name: 4-(2-allyl-4-chloro-phenoxy)butyl-diethyl-ammonium CAS Name: 4-(4-chloro-2-prop-2-enylphenoxy)butyl-diethylammonium IUPAC Name: 4-(4-chloro-2-prop-2-enylphenoxy)butyl-diethylazanium Traditional Name: 4-(2-allyl-4-chloro-phenoxy)butyl-diethyl-ammonium Formula: C17H27ClNO+ MolecularWeight: 296.85538

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCCOC1=C(C=C(C=C1)Cl)CC=C

Isomeric SMILES

CC[NH+](CC)CCCCOC1=C(C=C(C=C1)Cl)CC=C

InChI

InChI=1S/C17H26ClNO/c1-4-9-15-14-16(18)10-11-17(15)20-13-8-7-12-19(5-2)6-3/h4,10-11,14H,1,5-9,12-13H2,2-3H3/p+1