[(E)-(3,5-dimethoxyphenyl)methylideneamino] hept-6-ynoate

Systemtic Name: [(E)-(3,5-dimethoxyphenyl)methylideneamino] hept-6-ynoate Openeye Name: [(E)-(3,5-dimethoxyphenyl)methyleneamino] hept-6-ynoate CAS Name: 6-heptynoic acid [(E)-(3,5-dimethoxyphenyl)methylideneamino] ester IUPAC Name: [(E)-(3,5-dimethoxyphenyl)methylideneamino] hept-6-ynoate Traditional Name: hept-6-ynoic acid [(E)-(3,5-dimethoxybenzylidene)amino] ester Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C=NOC(=O)CCCCC#C)OC

Isomeric SMILES

COC1=CC(=CC(=C1)/C=N/OC(=O)CCCCC#C)OC

InChI

InChI=1S/C16H19NO4/c1-4-5-6-7-8-16(18)21-17-12-13-9-14(19-2)11-15(10-13)20-3/h1,9-12H,5-8H2,2-3H3/b17-12+