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

Systemtic Name: 6-[2-azanyl-5-(2-ethoxyphenoxy)-1H-pyrimidin-6-ylidene]-3-phenylmethoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[2-amino-5-(2-ethoxyphenoxy)-1H-pyrimidin-6-ylidene]-3-benzyloxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[2-amino-5-(2-ethoxyphenoxy)-1H-pyrimidin-6-ylidene]-3-phenylmethoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[2-amino-5-(2-ethoxyphenoxy)-1H-pyrimidin-6-ylidene]-3-phenylmethoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[2-amino-5-(2-ethoxyphenoxy)-1H-pyrimidin-6-ylidene]-3-benzoxy-cyclohexa-2,4-dien-1-one Formula: C25H23N3O4 MolecularWeight: 429.46782

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OC2=CN=C(NC2=C3C=CC(=CC3=O)OCC4=CC=CC=C4)N

Isomeric SMILES

CCOC1=CC=CC=C1OC2=CN=C(NC2=C3C=CC(=CC3=O)OCC4=CC=CC=C4)N

InChI

InChI=1S/C25H23N3O4/c1-2-30-21-10-6-7-11-22(21)32-23-15-27-25(26)28-24(23)19-13-12-18(14-20(19)29)31-16-17-8-4-3-5-9-17/h3-15H,2,16H2,1H3,(H3,26,27,28)