2-[(4Z)-4-[(5-methylthiophen-2-yl)methylidene]-1,3-bis(oxidanylidene)isoquinolin-2-yl]ethanoate

Systemtic Name: 2-[(4Z)-4-[(5-methylthiophen-2-yl)methylidene]-1,3-bis(oxidanylidene)isoquinolin-2-yl]ethanoate Openeye Name: 2-[(4Z)-4-[(5-methyl-2-thienyl)methylene]-1,3-dioxo-2-isoquinolyl]acetate CAS Name: 2-[(4Z)-4-[(5-methyl-2-thiophenyl)methylidene]-1,3-dioxo-2-isoquinolinyl]acetate IUPAC Name: 2-[(4Z)-4-[(5-methylthiophen-2-yl)methylidene]-1,3-dioxoisoquinolin-2-yl]acetate Traditional Name: 2-[(4Z)-1,3-diketo-4-[(5-methyl-2-thienyl)methylene]-2-isoquinolyl]acetate Formula: C17H12NO4S- MolecularWeight: 326.34648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C=C2C3=CC=CC=C3C(=O)N(C2=O)CC(=O)[O-]

Isomeric SMILES

CC1=CC=C(S1)/C=C\2/C3=CC=CC=C3C(=O)N(C2=O)CC(=O)[O-]

InChI

InChI=1S/C17H13NO4S/c1-10-6-7-11(23-10)8-14-12-4-2-3-5-13(12)16(21)18(17(14)22)9-15(19)20/h2-8H,9H2,1H3,(H,19,20)/p-1/b14-8-