N-[(E)-(3-ethoxy-4-phenylmethoxy-phenyl)methylideneamino]-5-methyl-1H-pyrazole-3-carboxamide

Systemtic Name: N-[(E)-(3-ethoxy-4-phenylmethoxy-phenyl)methylideneamino]-5-methyl-1H-pyrazole-3-carboxamide Openeye Name: N-[(E)-(4-benzyloxy-3-ethoxy-phenyl)methyleneamino]-5-methyl-1H-pyrazole-3-carboxamide CAS Name: N-[(E)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]-5-methyl-1H-pyrazole-3-carboxamide IUPAC Name: N-[(E)-(3-ethoxy-4-phenylmethoxyphenyl)methylideneamino]-5-methyl-1H-pyrazole-3-carboxamide Traditional Name: N-[(E)-(4-benzoxy-3-ethoxy-benzylidene)amino]-5-methyl-1H-pyrazole-3-carboxamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O3/c1-3-27-20-12-17(13-22-25-21(26)18-11-15(2)23-24-18)9-10-19(20)28-14-16-7-5-4-6-8-16/h4-13H,3,14H2,1-2H3,(H,23,24)(H,25,26)/b22-13+