3-[(4Z)-4-[(4-methoxy-3-oxidanyl-phenyl)methylidene]-1,3-bis(oxidanylidene)isoquinolin-2-yl]propanoate

Systemtic Name: 3-[(4Z)-4-[(4-methoxy-3-oxidanyl-phenyl)methylidene]-1,3-bis(oxidanylidene)isoquinolin-2-yl]propanoate Openeye Name: 3-[(4Z)-4-[(3-hydroxy-4-methoxy-phenyl)methylene]-1,3-dioxo-2-isoquinolyl]propanoate CAS Name: 3-[(4Z)-4-[(3-hydroxy-4-methoxyphenyl)methylidene]-1,3-dioxo-2-isoquinolinyl]propanoate IUPAC Name: 3-[(4Z)-4-[(3-hydroxy-4-methoxyphenyl)methylidene]-1,3-dioxoisoquinolin-2-yl]propanoate Traditional Name: 3-[(4Z)-4-(3-hydroxy-4-methoxy-benzylidene)-1,3-diketo-2-isoquinolyl]propionate Formula: C20H16NO6- MolecularWeight: 366.34414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C2C3=CC=CC=C3C(=O)N(C2=O)CCC(=O)[O-])O

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C\2/C3=CC=CC=C3C(=O)N(C2=O)CCC(=O)[O-])O

InChI

InChI=1S/C20H17NO6/c1-27-17-7-6-12(11-16(17)22)10-15-13-4-2-3-5-14(13)19(25)21(20(15)26)9-8-18(23)24/h2-7,10-11,22H,8-9H2,1H3,(H,23,24)/p-1/b15-10-