(6E)-6-[2-azanyl-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrimidin-6-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[2-azanyl-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrimidin-6-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[2-amino-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrimidin-6-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[2-amino-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrimidin-6-ylidene]-3-methoxy-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[2-amino-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrimidin-6-ylidene]-3-methoxycyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[2-amino-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrimidin-6-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one Formula: C19H17N3O4 MolecularWeight: 351.35598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=O)C(=C2C(=CN=C(N2)N)C3=CC4=C(C=C3)OCCO4)C=C1

Isomeric SMILES

COC1=CC(=O)/C(=C/2\C(=CN=C(N2)N)C3=CC4=C(C=C3)OCCO4)/C=C1

InChI

InChI=1S/C19H17N3O4/c1-24-12-3-4-13(15(23)9-12)18-14(10-21-19(20)22-18)11-2-5-16-17(8-11)26-7-6-25-16/h2-5,8-10H,6-7H2,1H3,(H3,20,21,22)/b18-13+