N-[(E)-(3-chloranyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylideneamino]-2-cyano-ethanamide

Systemtic Name: N-[(E)-(3-chloranyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylideneamino]-2-cyano-ethanamide Openeye Name: N-[(E)-(3-chloro-5-methoxy-4-prop-2-ynoxy-phenyl)methyleneamino]-2-cyano-acetamide CAS Name: N-[(E)-(3-chloro-5-methoxy-4-prop-2-ynoxyphenyl)methylideneamino]-2-cyanoacetamide IUPAC Name: N-[(E)-(3-chloro-5-methoxy-4-prop-2-ynoxyphenyl)methylideneamino]-2-cyanoacetamide Traditional Name: N-[(E)-(3-chloro-5-methoxy-4-propargyloxy-benzylidene)amino]-2-cyano-acetamide Formula: C14H12ClN3O3 MolecularWeight: 305.71638

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NNC(=O)CC#N)Cl)OCC#C

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=N/NC(=O)CC#N)Cl)OCC#C

InChI

InChI=1S/C14H12ClN3O3/c1-3-6-21-14-11(15)7-10(8-12(14)20-2)9-17-18-13(19)4-5-16/h1,7-9H,4,6H2,2H3,(H,18,19)/b17-9+