(4E)-2-methoxy-4-[[2-(3-methoxy-4-oxidanyl-phenyl)ethylamino]methylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-2-methoxy-4-[[2-(3-methoxy-4-oxidanyl-phenyl)ethylamino]methylidene]cyclohexa-2,5-dien-1-one Openeye Name: (4E)-4-[[2-(4-hydroxy-3-methoxy-phenyl)ethylamino]methylene]-2-methoxy-cyclohexa-2,5-dien-1-one CAS Name: (4E)-4-[[2-(4-hydroxy-3-methoxyphenyl)ethylamino]methylidene]-2-methoxy-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-4-[[2-(4-hydroxy-3-methoxyphenyl)ethylamino]methylidene]-2-methoxycyclohexa-2,5-dien-1-one Traditional Name: (4E)-4-[(homovanillylamino)methylene]-2-methoxy-cyclohexa-2,5-dien-1-one Formula: C17H19NO4 MolecularWeight: 301.33706

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNCCC2=CC(=C(C=C2)O)OC)C=CC1=O

Isomeric SMILES

COC1=C/C(=C/NCCC2=CC(=C(C=C2)O)OC)/C=CC1=O

InChI

InChI=1S/C17H19NO4/c1-21-16-9-12(3-5-14(16)19)7-8-18-11-13-4-6-15(20)17(10-13)22-2/h3-6,9-11,18-19H,7-8H2,1-2H3/b13-11+