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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17NO4/c1-20-15-5-2-4-12(17(15)19)11-18-13-6-7-14-16(10-13)22-9-3-8-21-14/h2,4-7,10-11,18H,3,8-9H2,1H3