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

Systemtic Name: 6-[2-azanyl-5-(3-methoxyphenoxy)-1H-pyrimidin-6-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[2-amino-5-(3-methoxyphenoxy)-1H-pyrimidin-6-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[2-amino-5-(3-methoxyphenoxy)-1H-pyrimidin-6-ylidene]-3-methoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[2-amino-5-(3-methoxyphenoxy)-1H-pyrimidin-6-ylidene]-3-methoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[2-amino-5-(3-methoxyphenoxy)-1H-pyrimidin-6-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=O)C(=C2C(=CN=C(N2)N)OC3=CC(=CC=C3)OC)C=C1

Isomeric SMILES

COC1=CC(=O)C(=C2C(=CN=C(N2)N)OC3=CC(=CC=C3)OC)C=C1

InChI

InChI=1S/C18H17N3O4/c1-23-11-4-3-5-13(8-11)25-16-10-20-18(19)21-17(16)14-7-6-12(24-2)9-15(14)22/h3-10H,1-2H3,(H3,19,20,21)