N-[(E)-(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)methylideneamino]pyridine-3-carboxamide

Systemtic Name: N-[(E)-(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)methylideneamino]pyridine-3-carboxamide Openeye Name: N-[(E)-(4-benzyloxy-3-bromo-5-ethoxy-phenyl)methyleneamino]pyridine-3-carboxamide CAS Name: N-[(E)-(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)methylideneamino]-3-pyridinecarboxamide IUPAC Name: N-[(E)-(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)methylideneamino]pyridine-3-carboxamide Traditional Name: N-[(E)-(4-benzoxy-3-bromo-5-ethoxy-benzylidene)amino]nicotinamide Formula: C22H20BrN3O3 MolecularWeight: 454.3165

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=NNC(=O)C2=CN=CC=C2)Br)OCC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=N/NC(=O)C2=CN=CC=C2)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C22H20BrN3O3/c1-2-28-20-12-17(13-25-26-22(27)18-9-6-10-24-14-18)11-19(23)21(20)29-15-16-7-4-3-5-8-16/h3-14H,2,15H2,1H3,(H,26,27)/b25-13+