N'-[4-(azepan-1-yl)-3-nitro-phenyl]carbonyl-2,4-dimethyl-benzohydrazide

Systemtic Name: N'-[4-(azepan-1-yl)-3-nitro-phenyl]carbonyl-2,4-dimethyl-benzohydrazide Openeye Name: N'-[4-(azepan-1-yl)-3-nitro-benzoyl]-2,4-dimethyl-benzohydrazide CAS Name: N'-[[4-(1-azepanyl)-3-nitrophenyl]-oxomethyl]-2,4-dimethylbenzohydrazide IUPAC Name: N'-[4-(azepan-1-yl)-3-nitrobenzoyl]-2,4-dimethylbenzohydrazide Traditional Name: N'-[4-(azepan-1-yl)-3-nitro-benzoyl]-2,4-dimethyl-benzohydrazide Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NNC(=O)C2=CC(=C(C=C2)N3CCCCCC3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)NNC(=O)C2=CC(=C(C=C2)N3CCCCCC3)[N+](=O)[O-])C

InChI

InChI=1S/C22H26N4O4/c1-15-7-9-18(16(2)13-15)22(28)24-23-21(27)17-8-10-19(20(14-17)26(29)30)25-11-5-3-4-6-12-25/h7-10,13-14H,3-6,11-12H2,1-2H3,(H,23,27)(H,24,28)