N'-[(E)-(4-methoxy-3-nitro-phenyl)methylideneamino]-N-(pyridin-3-ylmethyl)propanediamide

Systemtic Name: N'-[(E)-(4-methoxy-3-nitro-phenyl)methylideneamino]-N-(pyridin-3-ylmethyl)propanediamide Openeye Name: N'-[(E)-(4-methoxy-3-nitro-phenyl)methyleneamino]-N-(3-pyridylmethyl)propanediamide CAS Name: N'-[(E)-(4-methoxy-3-nitrophenyl)methylideneamino]-N-(3-pyridinylmethyl)propanediamide IUPAC Name: N'-[(E)-(4-methoxy-3-nitrophenyl)methylideneamino]-N-(pyridin-3-ylmethyl)propanediamide Traditional Name: N'-[(E)-(4-methoxy-3-nitro-benzylidene)amino]-N-(3-pyridylmethyl)malonamide Formula: C17H17N5O5 MolecularWeight: 371.34738

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=O)CC(=O)NCC2=CN=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC(=O)CC(=O)NCC2=CN=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O5/c1-27-15-5-4-12(7-14(15)22(25)26)11-20-21-17(24)8-16(23)19-10-13-3-2-6-18-9-13/h2-7,9,11H,8,10H2,1H3,(H,19,23)(H,21,24)/b20-11+