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

Systemtic Name: 4-chloranyl-N-[(E)-(3-methoxy-4-prop-2-enoxy-phenyl)methylideneamino]-3-nitro-benzamide Openeye Name: N-[(E)-(4-allyloxy-3-methoxy-phenyl)methyleneamino]-4-chloro-3-nitro-benzamide CAS Name: 4-chloro-N-[(E)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[(E)-(3-methoxy-4-prop-2-enoxyphenyl)methylideneamino]-3-nitrobenzamide Traditional Name: N-[(E)-(4-allyloxy-3-methoxy-benzylidene)amino]-4-chloro-3-nitro-benzamide Formula: C18H16ClN3O5 MolecularWeight: 389.78974

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16ClN3O5/c1-3-8-27-16-7-4-12(9-17(16)26-2)11-20-21-18(23)13-5-6-14(19)15(10-13)22(24)25/h3-7,9-11H,1,8H2,2H3,(H,21,23)/b20-11+