1-[[4-(4-propylphenoxy)phenyl]methyl]piperidin-1-ium-4-amine

Systemtic Name: 1-[[4-(4-propylphenoxy)phenyl]methyl]piperidin-1-ium-4-amine Openeye Name: 1-[[4-(4-propylphenoxy)phenyl]methyl]piperidin-1-ium-4-amine CAS Name: 1-[[4-(4-propylphenoxy)phenyl]methyl]-4-piperidin-1-iumamine IUPAC Name: 1-[[4-(4-propylphenoxy)phenyl]methyl]piperidin-1-ium-4-amine Traditional Name: [1-[4-(4-propylphenoxy)benzyl]piperidin-1-ium-4-yl]amine Formula: C21H29N2O+ MolecularWeight: 325.46776

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OC2=CC=C(C=C2)C[NH+]3CCC(CC3)N

Isomeric SMILES

CCCC1=CC=C(C=C1)OC2=CC=C(C=C2)C[NH+]3CCC(CC3)N

InChI

InChI=1S/C21H28N2O/c1-2-3-17-4-8-20(9-5-17)24-21-10-6-18(7-11-21)16-23-14-12-19(22)13-15-23/h4-11,19H,2-3,12-16,22H2,1H3/p+1