1-[(5-chloranyl-2-hexoxy-phenyl)methyl]piperidin-1-ium-4-amine

Systemtic Name: 1-[(5-chloranyl-2-hexoxy-phenyl)methyl]piperidin-1-ium-4-amine Openeye Name: 1-[(5-chloro-2-hexoxy-phenyl)methyl]piperidin-1-ium-4-amine CAS Name: 1-[(5-chloro-2-hexoxyphenyl)methyl]-4-piperidin-1-iumamine IUPAC Name: 1-[(5-chloro-2-hexoxyphenyl)methyl]piperidin-1-ium-4-amine Traditional Name: [1-(5-chloro-2-hexoxy-benzyl)piperidin-1-ium-4-yl]amine Formula: C18H30ClN2O+ MolecularWeight: 325.8966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)Cl)C[NH+]2CCC(CC2)N

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)Cl)C[NH+]2CCC(CC2)N

InChI

InChI=1S/C18H29ClN2O/c1-2-3-4-5-12-22-18-7-6-16(19)13-15(18)14-21-10-8-17(20)9-11-21/h6-7,13,17H,2-5,8-12,14,20H2,1H3/p+1