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

Systemtic Name: N-[(1S)-1-(4-chlorophenyl)butyl]-1-propyl-piperidin-1-ium-4-amine Openeye Name: N-[(1S)-1-(4-chlorophenyl)butyl]-1-propyl-piperidin-1-ium-4-amine CAS Name: N-[(1S)-1-(4-chlorophenyl)butyl]-1-propyl-4-piperidin-1-iumamine IUPAC Name: N-[(1S)-1-(4-chlorophenyl)butyl]-1-propylpiperidin-1-ium-4-amine Traditional Name: [(1S)-1-(4-chlorophenyl)butyl]-(1-propylpiperidin-1-ium-4-yl)amine Formula: C18H30ClN2+ MolecularWeight: 309.8972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H29ClN2/c1-3-5-18(15-6-8-16(19)9-7-15)20-17-10-13-21(12-4-2)14-11-17/h6-9,17-18,20H,3-5,10-14H2,1-2H3/p+1/t18-/m0/s1