N-[(1R)-5-(diethylamino)-1-phenyl-pentyl]-4-nitro-benzamide

Systemtic Name: N-[(1R)-5-(diethylamino)-1-phenyl-pentyl]-4-nitro-benzamide Openeye Name: N-[(1R)-5-(diethylamino)-1-phenyl-pentyl]-4-nitro-benzamide CAS Name: N-[(1R)-5-(diethylamino)-1-phenylpentyl]-4-nitrobenzamide IUPAC Name: N-[(1R)-5-(diethylamino)-1-phenylpentyl]-4-nitrobenzamide Traditional Name: N-[(1R)-5-(diethylamino)-1-phenyl-pentyl]-4-nitro-benzamide Formula: C22H29N3O3 MolecularWeight: 383.48396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCCC(C1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCCC[C@H](C1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C22H29N3O3/c1-3-24(4-2)17-9-8-12-21(18-10-6-5-7-11-18)23-22(26)19-13-15-20(16-14-19)25(27)28/h5-7,10-11,13-16,21H,3-4,8-9,12,17H2,1-2H3,(H,23,26)/t21-/m1/s1