N'-[4-(azepan-1-yl)-3-nitro-phenyl]carbonyl-2-methyl-furan-3-carbohydrazide

Systemtic Name: N'-[4-(azepan-1-yl)-3-nitro-phenyl]carbonyl-2-methyl-furan-3-carbohydrazide Openeye Name: N'-[4-(azepan-1-yl)-3-nitro-benzoyl]-2-methyl-furan-3-carbohydrazide CAS Name: N'-[[4-(1-azepanyl)-3-nitrophenyl]-oxomethyl]-2-methyl-3-furancarbohydrazide IUPAC Name: N'-[4-(azepan-1-yl)-3-nitrobenzoyl]-2-methylfuran-3-carbohydrazide Traditional Name: N'-[4-(azepan-1-yl)-3-nitro-benzoyl]-2-methyl-3-furohydrazide Formula: C19H22N4O5 MolecularWeight: 386.40178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C(=O)NNC(=O)C2=CC(=C(C=C2)N3CCCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CO1)C(=O)NNC(=O)C2=CC(=C(C=C2)N3CCCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O5/c1-13-15(8-11-28-13)19(25)21-20-18(24)14-6-7-16(17(12-14)23(26)27)22-9-4-2-3-5-10-22/h6-8,11-12H,2-5,9-10H2,1H3,(H,20,24)(H,21,25)