4-[(2E)-2-(3H-1,3-benzoxazol-2-ylidene)-2-chloranyl-ethylidene]-2,6-dimethoxy-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[(2E)-2-(3H-1,3-benzoxazol-2-ylidene)-2-chloranyl-ethylidene]-2,6-dimethoxy-cyclohexa-2,5-dien-1-one Openeye Name: 4-[(2E)-2-(3H-1,3-benzoxazol-2-ylidene)-2-chloro-ethylidene]-2,6-dimethoxy-cyclohexa-2,5-dien-1-one CAS Name: 4-[(2E)-2-(3H-1,3-benzoxazol-2-ylidene)-2-chloroethylidene]-2,6-dimethoxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-[(2E)-2-(3H-1,3-benzoxazol-2-ylidene)-2-chloroethylidene]-2,6-dimethoxycyclohexa-2,5-dien-1-one Traditional Name: 4-[(2E)-2-(3H-1,3-benzoxazol-2-ylidene)-2-chloro-ethylidene]-2,6-dimethoxy-cyclohexa-2,5-dien-1-one Formula: C17H14ClNO4 MolecularWeight: 331.75036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C2NC3=CC=CC=C3O2)Cl)C=C(C1=O)OC

Isomeric SMILES

COC1=CC(=C/C(=C\2/NC3=CC=CC=C3O2)/Cl)C=C(C1=O)OC

InChI

InChI=1S/C17H14ClNO4/c1-21-14-8-10(9-15(22-2)16(14)20)7-11(18)17-19-12-5-3-4-6-13(12)23-17/h3-9,19H,1-2H3/b17-11+