4-acetamido-N-[(3-nitro-4-piperidin-1-yl-phenyl)methylideneamino]benzamide

Systemtic Name: 4-acetamido-N-[(3-nitro-4-piperidin-1-yl-phenyl)methylideneamino]benzamide Openeye Name: 4-acetamido-N-[[3-nitro-4-(1-piperidyl)phenyl]methyleneamino]benzamide CAS Name: 4-acetamido-N-[[3-nitro-4-(1-piperidinyl)phenyl]methylideneamino]benzamide IUPAC Name: 4-acetamido-N-[(3-nitro-4-piperidin-1-ylphenyl)methylideneamino]benzamide Traditional Name: 4-acetamido-N-[(3-nitro-4-piperidino-benzylidene)amino]benzamide Formula: C21H23N5O4 MolecularWeight: 409.43842

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)NN=CC2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)NN=CC2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H23N5O4/c1-15(27)23-18-8-6-17(7-9-18)21(28)24-22-14-16-5-10-19(20(13-16)26(29)30)25-11-3-2-4-12-25/h5-10,13-14H,2-4,11-12H2,1H3,(H,23,27)(H,24,28)