2-[2-[4-(azepan-1-yl)-3-nitro-phenyl]carbonylhydrazinyl]-N-cyclopropyl-2-oxidanylidene-ethanamide

Systemtic Name: 2-[2-[4-(azepan-1-yl)-3-nitro-phenyl]carbonylhydrazinyl]-N-cyclopropyl-2-oxidanylidene-ethanamide Openeye Name: 2-[2-[4-(azepan-1-yl)-3-nitro-benzoyl]hydrazino]-N-cyclopropyl-2-oxo-acetamide CAS Name: 2-[[[4-(1-azepanyl)-3-nitrophenyl]-oxomethyl]hydrazo]-N-cyclopropyl-2-oxoacetamide IUPAC Name: 2-[2-[4-(azepan-1-yl)-3-nitrobenzoyl]hydrazinyl]-N-cyclopropyl-2-oxoacetamide Traditional Name: 2-[N'-[4-(azepan-1-yl)-3-nitro-benzoyl]hydrazino]-N-cyclopropyl-2-keto-acetamide Formula: C18H23N5O5 MolecularWeight: 389.40572

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)C(=O)NNC(=O)C(=O)NC3CC3)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)C(=O)NNC(=O)C(=O)NC3CC3)[N+](=O)[O-]

InChI

InChI=1S/C18H23N5O5/c24-16(20-21-18(26)17(25)19-13-6-7-13)12-5-8-14(15(11-12)23(27)28)22-9-3-1-2-4-10-22/h5,8,11,13H,1-4,6-7,9-10H2,(H,19,25)(H,20,24)(H,21,26)