N-[2-(3,4-dimethoxyphenyl)ethyl]-5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-2H-1,2-oxazole-3-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-2H-1,2-oxazole-3-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-2H-isoxazole-3-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-(4-oxo-1-cyclohexa-2,5-dienylidene)-2H-isoxazole-3-carboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-2H-1,2-oxazole-3-carboxamide Traditional Name: N-homoveratryl-5-(4-ketocyclohexa-2,5-dien-1-ylidene)-3-isoxazoline-3-carboxamide Formula: C20H20N2O5 MolecularWeight: 368.3832

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=CC(=C3C=CC(=O)C=C3)ON2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=CC(=C3C=CC(=O)C=C3)ON2)OC

InChI

InChI=1S/C20H20N2O5/c1-25-17-8-3-13(11-19(17)26-2)9-10-21-20(24)16-12-18(27-22-16)14-4-6-15(23)7-5-14/h3-8,11-12,22H,9-10H2,1-2H3,(H,21,24)