2-[4-(4-chloranyl-2-prop-2-enyl-phenoxy)butylazaniumyl]ethyl-dimethyl-azanium

Systemtic Name: 2-[4-(4-chloranyl-2-prop-2-enyl-phenoxy)butylazaniumyl]ethyl-dimethyl-azanium Openeye Name: 2-[4-(2-allyl-4-chloro-phenoxy)butylammonio]ethyl-dimethyl-ammonium CAS Name: 2-[4-(4-chloro-2-prop-2-enylphenoxy)butylammonio]ethyl-dimethylammonium IUPAC Name: 2-[4-(4-chloro-2-prop-2-enylphenoxy)butylazaniumyl]ethyl-dimethylazanium Traditional Name: 2-[4-(2-allyl-4-chloro-phenoxy)butylammonio]ethyl-dimethyl-ammonium Formula: C17H29ClN2O+2 MolecularWeight: 312.87796

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC[NH2+]CCCCOC1=C(C=C(C=C1)Cl)CC=C

Isomeric SMILES

C[NH+](C)CC[NH2+]CCCCOC1=C(C=C(C=C1)Cl)CC=C

InChI

InChI=1S/C17H27ClN2O/c1-4-7-15-14-16(18)8-9-17(15)21-13-6-5-10-19-11-12-20(2)3/h4,8-9,14,19H,1,5-7,10-13H2,2-3H3/p+2