N-[(1R)-1-(2-nitrophenyl)ethyl]-1-propyl-piperidin-1-ium-4-amine

Systemtic Name: N-[(1R)-1-(2-nitrophenyl)ethyl]-1-propyl-piperidin-1-ium-4-amine Openeye Name: N-[(1R)-1-(2-nitrophenyl)ethyl]-1-propyl-piperidin-1-ium-4-amine CAS Name: N-[(1R)-1-(2-nitrophenyl)ethyl]-1-propyl-4-piperidin-1-iumamine IUPAC Name: N-[(1R)-1-(2-nitrophenyl)ethyl]-1-propylpiperidin-1-ium-4-amine Traditional Name: [(1R)-1-(2-nitrophenyl)ethyl]-(1-propylpiperidin-1-ium-4-yl)amine Formula: C16H26N3O2+ MolecularWeight: 292.39654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NC(C)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCC[NH+]1CCC(CC1)N[C@H](C)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H25N3O2/c1-3-10-18-11-8-14(9-12-18)17-13(2)15-6-4-5-7-16(15)19(20)21/h4-7,13-14,17H,3,8-12H2,1-2H3/p+1/t13-/m1/s1