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

Systemtic Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-nitro-5-pyrrolidin-1-yl-aniline Openeye Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-nitro-5-pyrrolidin-1-yl-aniline CAS Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-nitro-5-(1-pyrrolidinyl)aniline IUPAC Name: N-[(1R)-1-(1-adamantyl)ethyl]-2-nitro-5-pyrrolidin-1-ylaniline Traditional Name: [(1R)-1-(1-adamantyl)ethyl]-(2-nitro-5-pyrrolidino-phenyl)amine Formula: C22H31N3O2 MolecularWeight: 369.50044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC4=C(C=CC(=C4)N5CCCC5)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C12CC3CC(C1)CC(C3)C2)NC4=C(C=CC(=C4)N5CCCC5)[N+](=O)[O-]

InChI

InChI=1S/C22H31N3O2/c1-15(22-12-16-8-17(13-22)10-18(9-16)14-22)23-20-11-19(24-6-2-3-7-24)4-5-21(20)25(26)27/h4-5,11,15-18,23H,2-3,6-10,12-14H2,1H3/t15-,16?,17?,18?,22?/m1/s1