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

Systemtic Name: N-(2-methoxy-5-phenyl-phenyl)-1-propyl-piperidin-1-ium-4-amine Openeye Name: N-(2-methoxy-5-phenyl-phenyl)-1-propyl-piperidin-1-ium-4-amine CAS Name: N-(2-methoxy-5-phenylphenyl)-1-propyl-4-piperidin-1-iumamine IUPAC Name: N-(2-methoxy-5-phenylphenyl)-1-propylpiperidin-1-ium-4-amine Traditional Name: (2-methoxy-5-phenyl-phenyl)-(1-propylpiperidin-1-ium-4-yl)amine Formula: C21H29N2O+ MolecularWeight: 325.46776

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NC2=C(C=CC(=C2)C3=CC=CC=C3)OC

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC2=C(C=CC(=C2)C3=CC=CC=C3)OC

InChI

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