[(5S,7R)-3-(4-nitrophenyl)-1-adamantyl]-piperidin-1-yl-methanone

Systemtic Name: [(5S,7R)-3-(4-nitrophenyl)-1-adamantyl]-piperidin-1-yl-methanone Openeye Name: [(5S,7R)-3-(4-nitrophenyl)-1-adamantyl]-(1-piperidyl)methanone CAS Name: [(5S,7R)-3-(4-nitrophenyl)-1-adamantyl]-(1-piperidinyl)methanone IUPAC Name: [(5S,7R)-3-(4-nitrophenyl)-1-adamantyl]-piperidin-1-ylmethanone Traditional Name: [(5S,7R)-3-(4-nitrophenyl)-1-adamantyl]-piperidino-methanone Formula: C22H28N2O3 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C23CC4CC(C2)CC(C4)(C3)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=O)C23C[C@@H]4C[C@H](C2)CC(C4)(C3)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H28N2O3/c25-20(23-8-2-1-3-9-23)22-13-16-10-17(14-22)12-21(11-16,15-22)18-4-6-19(7-5-18)24(26)27/h4-7,16-17H,1-3,8-15H2/t16-,17+,21?,22?