N-[(1S)-1-phenylbutyl]-1-propyl-piperidin-1-ium-4-amine

Systemtic Name: N-[(1S)-1-phenylbutyl]-1-propyl-piperidin-1-ium-4-amine Openeye Name: N-[(1S)-1-phenylbutyl]-1-propyl-piperidin-1-ium-4-amine CAS Name: N-[(1S)-1-phenylbutyl]-1-propyl-4-piperidin-1-iumamine IUPAC Name: N-[(1S)-1-phenylbutyl]-1-propylpiperidin-1-ium-4-amine Traditional Name: [(1S)-1-phenylbutyl]-(1-propylpiperidin-1-ium-4-yl)amine Formula: C18H31N2+ MolecularWeight: 275.45214

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC2CC[NH+](CC2)CCC

Isomeric SMILES

CCC[C@@H](C1=CC=CC=C1)NC2CC[NH+](CC2)CCC

InChI

InChI=1S/C18H30N2/c1-3-8-18(16-9-6-5-7-10-16)19-17-11-14-20(13-4-2)15-12-17/h5-7,9-10,17-19H,3-4,8,11-15H2,1-2H3/p+1/t18-/m0/s1