N-(2-methoxy-5-methyl-phenyl)-1-propyl-piperidin-1-ium-4-amine

Systemtic Name: N-(2-methoxy-5-methyl-phenyl)-1-propyl-piperidin-1-ium-4-amine Openeye Name: N-(2-methoxy-5-methyl-phenyl)-1-propyl-piperidin-1-ium-4-amine CAS Name: N-(2-methoxy-5-methylphenyl)-1-propyl-4-piperidin-1-iumamine IUPAC Name: N-(2-methoxy-5-methylphenyl)-1-propylpiperidin-1-ium-4-amine Traditional Name: (2-methoxy-5-methyl-phenyl)-(1-propylpiperidin-1-ium-4-yl)amine Formula: C16H27N2O+ MolecularWeight: 263.39838

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NC2=C(C=CC(=C2)C)OC

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC2=C(C=CC(=C2)C)OC

InChI

InChI=1S/C16H26N2O/c1-4-9-18-10-7-14(8-11-18)17-15-12-13(2)5-6-16(15)19-3/h5-6,12,14,17H,4,7-11H2,1-3H3/p+1