N-cyclopropyl-3-nitro-4-[4-(2-oxidanylidene-2-phenylazanyl-ethyl)piperazin-1-yl]benzamide

Systemtic Name: N-cyclopropyl-3-nitro-4-[4-(2-oxidanylidene-2-phenylazanyl-ethyl)piperazin-1-yl]benzamide Openeye Name: 4-[4-(2-anilino-2-oxo-ethyl)piperazin-1-yl]-N-cyclopropyl-3-nitro-benzamide CAS Name: 4-[4-(2-anilino-2-oxoethyl)-1-piperazinyl]-N-cyclopropyl-3-nitrobenzamide IUPAC Name: 4-[4-(2-anilino-2-oxoethyl)piperazin-1-yl]-N-cyclopropyl-3-nitrobenzamide Traditional Name: 4-[4-(2-anilino-2-keto-ethyl)piperazino]-N-cyclopropyl-3-nitro-benzamide Formula: C22H25N5O4 MolecularWeight: 423.465

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)CC(=O)NC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)CC(=O)NC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H25N5O4/c28-21(23-17-4-2-1-3-5-17)15-25-10-12-26(13-11-25)19-9-6-16(14-20(19)27(30)31)22(29)24-18-7-8-18/h1-6,9,14,18H,7-8,10-13,15H2,(H,23,28)(H,24,29)