2-chloranyl-N-[(E)-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]methylideneamino]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[(E)-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]methylideneamino]-4-nitro-benzamide Openeye Name: 2-chloro-N-[(E)-[4-methoxy-3-(morpholinomethyl)phenyl]methyleneamino]-4-nitro-benzamide CAS Name: 2-chloro-N-[(E)-[4-methoxy-3-(4-morpholinylmethyl)phenyl]methylideneamino]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[(E)-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]methylideneamino]-4-nitrobenzamide Traditional Name: 2-chloro-N-[(E)-[4-methoxy-3-(morpholinomethyl)benzylidene]amino]-4-nitro-benzamide Formula: C20H21ClN4O5 MolecularWeight: 432.85754

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)CN3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)CN3CCOCC3

InChI

InChI=1S/C20H21ClN4O5/c1-29-19-5-2-14(10-15(19)13-24-6-8-30-9-7-24)12-22-23-20(26)17-4-3-16(25(27)28)11-18(17)21/h2-5,10-12H,6-9,13H2,1H3,(H,23,26)/b22-12+