[(3R)-1-[(2-nitrophenyl)methyl]piperidin-1-ium-3-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [(3R)-1-[(2-nitrophenyl)methyl]piperidin-1-ium-3-yl]-pyrrolidin-1-yl-methanone Openeye Name: [(3R)-1-[(2-nitrophenyl)methyl]piperidin-1-ium-3-yl]-pyrrolidin-1-yl-methanone CAS Name: [(3R)-1-[(2-nitrophenyl)methyl]-3-piperidin-1-iumyl]-(1-pyrrolidinyl)methanone IUPAC Name: [(3R)-1-[(2-nitrophenyl)methyl]piperidin-1-ium-3-yl]-pyrrolidin-1-ylmethanone Traditional Name: [(3R)-1-(2-nitrobenzyl)piperidin-1-ium-3-yl]-pyrrolidino-methanone Formula: C17H24N3O3+ MolecularWeight: 318.39076

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2CCC[NH+](C2)CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)[C@@H]2CCC[NH+](C2)CC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C17H23N3O3/c21-17(19-10-3-4-11-19)15-7-5-9-18(13-15)12-14-6-1-2-8-16(14)20(22)23/h1-2,6,8,15H,3-5,7,9-13H2/p+1/t15-/m1/s1