2-[(5R,7S)-3-(4-nitrophenyl)-1-adamantyl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[(5R,7S)-3-(4-nitrophenyl)-1-adamantyl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[(5R,7S)-3-(4-nitrophenyl)-1-adamantyl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[(5R,7S)-3-(4-nitrophenyl)-1-adamantyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[(5R,7S)-3-(4-nitrophenyl)-1-adamantyl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[(5R,7S)-3-(4-nitrophenyl)-1-adamantyl]-1-pyrrolidino-ethanone Formula: C22H28N2O3 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CC23CC4CC(C2)CC(C4)(C3)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)CC23C[C@H]4C[C@@H](C2)CC(C4)(C3)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H28N2O3/c25-20(23-7-1-2-8-23)14-21-10-16-9-17(11-21)13-22(12-16,15-21)18-3-5-19(6-4-18)24(26)27/h3-6,16-17H,1-2,7-15H2/t16-,17+,21?,22?