N'-[5-(diethylamino)-1-phenyl-pentyl]-4-nitro-benzenecarboximidamide

Systemtic Name: N'-[5-(diethylamino)-1-phenyl-pentyl]-4-nitro-benzenecarboximidamide Openeye Name: N'-[5-(diethylamino)-1-phenyl-pentyl]-4-nitro-benzamidine CAS Name: N'-[5-(diethylamino)-1-phenylpentyl]-4-nitrobenzenecarboximidamide IUPAC Name: N'-[5-(diethylamino)-1-phenylpentyl]-4-nitrobenzenecarboximidamide Traditional Name: N'-[5-(diethylamino)-1-phenyl-pentyl]-4-nitro-benzamidine Formula: C22H30N4O2 MolecularWeight: 382.4992

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N4O2/c1-3-25(4-2)17-9-8-12-21(18-10-6-5-7-11-18)24-22(23)19-13-15-20(16-14-19)26(27)28/h5-7,10-11,13-16,21H,3-4,8-9,12,17H2,1-2H3,(H2,23,24)