3-methoxy-6-[4-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 3-methoxy-6-[4-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 3-methoxy-6-[4-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 3-methoxy-6-[4-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 3-methoxy-6-[4-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 3-methoxy-6-[4-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-ylidene]cyclohexa-2,4-dien-1-one Formula: C17H13F3N2O2 MolecularWeight: 334.29253

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=O)C(=C2CC(=NC3=CC=CC=C3N2)C(F)(F)F)C=C1

Isomeric SMILES

COC1=CC(=O)C(=C2CC(=NC3=CC=CC=C3N2)C(F)(F)F)C=C1

InChI

InChI=1S/C17H13F3N2O2/c1-24-10-6-7-11(15(23)8-10)14-9-16(17(18,19)20)22-13-5-3-2-4-12(13)21-14/h2-8,21H,9H2,1H3