N-[(1R)-1-(1-adamantyl)ethyl]-2-nitro-5-piperidin-1-yl-aniline

Systemtic Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-nitro-5-piperidin-1-yl-aniline Openeye Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-nitro-5-(1-piperidyl)aniline CAS Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-nitro-5-(1-piperidinyl)aniline IUPAC Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-nitro-5-piperidin-1-ylaniline Traditional Name: [(1R)-1-(1-adamantyl)ethyl]-(2-nitro-5-piperidino-phenyl)amine Formula: C23H33N3O2 MolecularWeight: 383.52702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC4=C(C=CC(=C4)N5CCCCC5)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C12CC3CC(C1)CC(C3)C2)NC4=C(C=CC(=C4)N5CCCCC5)[N+](=O)[O-]

InChI

InChI=1S/C23H33N3O2/c1-16(23-13-17-9-18(14-23)11-19(10-17)15-23)24-21-12-20(5-6-22(21)26(27)28)25-7-3-2-4-8-25/h5-6,12,16-19,24H,2-4,7-11,13-15H2,1H3/t16-,17?,18?,19?,23?/m1/s1