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

Systemtic Name: N'-[4-(azepan-1-yl)-3-nitro-phenyl]carbonyl-4-bromanyl-1-methyl-pyrrole-2-carbohydrazide Openeye Name: N'-[4-(azepan-1-yl)-3-nitro-benzoyl]-4-bromo-1-methyl-pyrrole-2-carbohydrazide CAS Name: N'-[[4-(1-azepanyl)-3-nitrophenyl]-oxomethyl]-4-bromo-1-methyl-2-pyrrolecarbohydrazide IUPAC Name: N'-[4-(azepan-1-yl)-3-nitrobenzoyl]-4-bromo-1-methylpyrrole-2-carbohydrazide Traditional Name: N'-[4-(azepan-1-yl)-3-nitro-benzoyl]-4-bromo-1-methyl-pyrrole-2-carbohydrazide Formula: C19H22BrN5O4 MolecularWeight: 464.31308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NNC(=O)C2=CC(=C(C=C2)N3CCCCCC3)[N+](=O)[O-])Br

Isomeric SMILES

CN1C=C(C=C1C(=O)NNC(=O)C2=CC(=C(C=C2)N3CCCCCC3)[N+](=O)[O-])Br

InChI

InChI=1S/C19H22BrN5O4/c1-23-12-14(20)11-17(23)19(27)22-21-18(26)13-6-7-15(16(10-13)25(28)29)24-8-4-2-3-5-9-24/h6-7,10-12H,2-5,8-9H2,1H3,(H,21,26)(H,22,27)