N'-(3-methylbutyl)-4-(naphthalen-1-ylmethylamino)-3-nitro-benzenecarboximidamide

Systemtic Name: N'-(3-methylbutyl)-4-(naphthalen-1-ylmethylamino)-3-nitro-benzenecarboximidamide Openeye Name: N'-isopentyl-4-(1-naphthylmethylamino)-3-nitro-benzamidine CAS Name: N'-(3-methylbutyl)-4-(1-naphthalenylmethylamino)-3-nitrobenzenecarboximidamide IUPAC Name: N'-(3-methylbutyl)-4-(naphthalen-1-ylmethylamino)-3-nitrobenzenecarboximidamide Traditional Name: N'-isoamyl-4-(1-naphthylmethylamino)-3-nitro-benzamidine Formula: C23H26N4O2 MolecularWeight: 390.47814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN=C(C1=CC(=C(C=C1)NCC2=CC=CC3=CC=CC=C32)[N+](=O)[O-])N

Isomeric SMILES

CC(C)CCN=C(C1=CC(=C(C=C1)NCC2=CC=CC3=CC=CC=C32)[N+](=O)[O-])N

InChI

InChI=1S/C23H26N4O2/c1-16(2)12-13-25-23(24)18-10-11-21(22(14-18)27(28)29)26-15-19-8-5-7-17-6-3-4-9-20(17)19/h3-11,14,16,26H,12-13,15H2,1-2H3,(H2,24,25)