4-chloranyl-3-nitro-N-[(E)-[4-(2-oxidanylidene-2-piperidin-1-yl-ethoxy)phenyl]methylideneamino]benzamide

Systemtic Name: 4-chloranyl-3-nitro-N-[(E)-[4-(2-oxidanylidene-2-piperidin-1-yl-ethoxy)phenyl]methylideneamino]benzamide Openeye Name: 4-chloro-3-nitro-N-[(E)-[4-[2-oxo-2-(1-piperidyl)ethoxy]phenyl]methyleneamino]benzamide CAS Name: 4-chloro-3-nitro-N-[(E)-[4-[2-oxo-2-(1-piperidinyl)ethoxy]phenyl]methylideneamino]benzamide IUPAC Name: 4-chloro-3-nitro-N-[(E)-[4-(2-oxo-2-piperidin-1-ylethoxy)phenyl]methylideneamino]benzamide Traditional Name: 4-chloro-N-[(E)-[4-(2-keto-2-piperidino-ethoxy)benzylidene]amino]-3-nitro-benzamide Formula: C21H21ClN4O5 MolecularWeight: 444.86824

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)COC2=CC=C(C=C2)C=NNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=O)COC2=CC=C(C=C2)/C=N/NC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H21ClN4O5/c22-18-9-6-16(12-19(18)26(29)30)21(28)24-23-13-15-4-7-17(8-5-15)31-14-20(27)25-10-2-1-3-11-25/h4-9,12-13H,1-3,10-11,14H2,(H,24,28)/b23-13+