4-imidazol-1-yl-3-nitro-N-[4-(4-oxidanylpiperidin-1-yl)phenyl]benzamide

Systemtic Name: 4-imidazol-1-yl-3-nitro-N-[4-(4-oxidanylpiperidin-1-yl)phenyl]benzamide Openeye Name: N-[4-(4-hydroxy-1-piperidyl)phenyl]-4-imidazol-1-yl-3-nitro-benzamide CAS Name: N-[4-(4-hydroxy-1-piperidinyl)phenyl]-4-(1-imidazolyl)-3-nitrobenzamide IUPAC Name: N-[4-(4-hydroxypiperidin-1-yl)phenyl]-4-imidazol-1-yl-3-nitrobenzamide Traditional Name: N-[4-(4-hydroxypiperidino)phenyl]-4-imidazol-1-yl-3-nitro-benzamide Formula: C21H21N5O4 MolecularWeight: 407.42254

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H21N5O4/c27-18-7-10-24(11-8-18)17-4-2-16(3-5-17)23-21(28)15-1-6-19(20(13-15)26(29)30)25-12-9-22-14-25/h1-6,9,12-14,18,27H,7-8,10-11H2,(H,23,28)