[(1R)-1-(3-nitrophenyl)ethyl]-(1-propan-2-ylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [(1R)-1-(3-nitrophenyl)ethyl]-(1-propan-2-ylpiperidin-1-ium-4-yl)azanium Openeye Name: (1-isopropylpiperidin-1-ium-4-yl)-[(1R)-1-(3-nitrophenyl)ethyl]ammonium CAS Name: [(1R)-1-(3-nitrophenyl)ethyl]-(1-propan-2-yl-4-piperidin-1-iumyl)ammonium IUPAC Name: [(1R)-1-(3-nitrophenyl)ethyl]-(1-propan-2-ylpiperidin-1-ium-4-yl)azanium Traditional Name: (1-isopropylpiperidin-1-ium-4-yl)-[(1R)-1-(3-nitrophenyl)ethyl]ammonium Formula: C16H27N3O2+2 MolecularWeight: 293.40448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)[NH2+]C(C)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1=CC(=CC=C1)[N+](=O)[O-])[NH2+]C2CC[NH+](CC2)C(C)C

InChI

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