N-[(E)-(4-methoxy-3-phenylmethoxy-phenyl)methylideneamino]-2-pyridin-1-ium-1-yl-ethanamide chloride

Systemtic Name: N-[(E)-(4-methoxy-3-phenylmethoxy-phenyl)methylideneamino]-2-pyridin-1-ium-1-yl-ethanamide chloride Openeye Name: N-[(E)-(3-benzyloxy-4-methoxy-phenyl)methyleneamino]-2-pyridin-1-ium-1-yl-acetamide chloride CAS Name: N-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]-2-(1-pyridin-1-iumyl)acetamide chloride IUPAC Name: N-[(E)-(4-methoxy-3-phenylmethoxyphenyl)methylideneamino]-2-pyridin-1-ium-1-ylacetamide chloride Traditional Name: N-[(E)-(3-benzoxy-4-methoxy-benzylidene)amino]-2-pyridin-1-ium-1-yl-acetamide chloride Formula: C22H22ClN3O3 MolecularWeight: 411.88138

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=O)C[N+]2=CC=CC=C2)OCC3=CC=CC=C3.[Cl-]

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC(=O)C[N+]2=CC=CC=C2)OCC3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C22H21N3O3.ClH/c1-27-20-11-10-19(14-21(20)28-17-18-8-4-2-5-9-18)15-23-24-22(26)16-25-12-6-3-7-13-25;/h2-15H,16-17H2,1H3;1H/b23-15+;