6-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)methylidene]-4-methoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)methylidene]-4-methoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)methylene]-4-methoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)methylidene]-4-methoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)methylidene]-4-methoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)methylene]-4-methoxy-cyclohexa-2,4-dien-1-one Formula: C17H17NO4 MolecularWeight: 299.32118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNC2=CC3=C(C=C2)OCCCO3)C(=O)C=C1

Isomeric SMILES

COC1=CC(=CNC2=CC3=C(C=C2)OCCCO3)C(=O)C=C1

InChI

InChI=1S/C17H17NO4/c1-20-14-4-5-15(19)12(9-14)11-18-13-3-6-16-17(10-13)22-8-2-7-21-16/h3-6,9-11,18H,2,7-8H2,1H3