3-methyl-4-nitro-N'-[4-oxidanylidene-4-(4-phenylpiperazin-1-yl)butanoyl]benzohydrazide

Systemtic Name: 3-methyl-4-nitro-N'-[4-oxidanylidene-4-(4-phenylpiperazin-1-yl)butanoyl]benzohydrazide Openeye Name: 3-methyl-4-nitro-N'-[4-oxo-4-(4-phenylpiperazin-1-yl)butanoyl]benzohydrazide CAS Name: N'-[1,4-dioxo-4-(4-phenyl-1-piperazinyl)butyl]-3-methyl-4-nitrobenzohydrazide IUPAC Name: 3-methyl-4-nitro-N'-[4-oxo-4-(4-phenylpiperazin-1-yl)butanoyl]benzohydrazide Traditional Name: N'-[4-keto-4-(4-phenylpiperazino)butanoyl]-3-methyl-4-nitro-benzohydrazide Formula: C22H25N5O5 MolecularWeight: 439.4644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NNC(=O)CCC(=O)N2CCN(CC2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NNC(=O)CCC(=O)N2CCN(CC2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H25N5O5/c1-16-15-17(7-8-19(16)27(31)32)22(30)24-23-20(28)9-10-21(29)26-13-11-25(12-14-26)18-5-3-2-4-6-18/h2-8,15H,9-14H2,1H3,(H,23,28)(H,24,30)