N7-butyl-4-nitro-N5-(phenylmethyl)-2,1,3-benzoxadiazole-5,7-diamine

Systemtic Name: N7-butyl-4-nitro-N5-(phenylmethyl)-2,1,3-benzoxadiazole-5,7-diamine Openeye Name: N5-benzyl-N7-butyl-4-nitro-2,1,3-benzoxadiazole-5,7-diamine CAS Name: N7-butyl-4-nitro-N5-(phenylmethyl)-2,1,3-benzoxadiazole-5,7-diamine IUPAC Name: 5-N-benzyl-7-N-butyl-4-nitro-2,1,3-benzoxadiazole-5,7-diamine Traditional Name: benzyl-[7-(butylamino)-4-nitro-benzofurazan-5-yl]amine Formula: C17H19N5O3 MolecularWeight: 341.36446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=CC(=C(C2=NON=C12)[N+](=O)[O-])NCC3=CC=CC=C3

Isomeric SMILES

CCCCNC1=CC(=C(C2=NON=C12)[N+](=O)[O-])NCC3=CC=CC=C3

InChI

InChI=1S/C17H19N5O3/c1-2-3-9-18-13-10-14(19-11-12-7-5-4-6-8-12)17(22(23)24)16-15(13)20-25-21-16/h4-8,10,18-19H,2-3,9,11H2,1H3