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

Systemtic Name: 3-[(4Z)-4-[(5-methylthiophen-2-yl)methylidene]-1,3-bis(oxidanylidene)isoquinolin-2-yl]propanoate Openeye Name: 3-[(4Z)-4-[(5-methyl-2-thienyl)methylene]-1,3-dioxo-2-isoquinolyl]propanoate CAS Name: 3-[(4Z)-4-[(5-methyl-2-thiophenyl)methylidene]-1,3-dioxo-2-isoquinolinyl]propanoate IUPAC Name: 3-[(4Z)-4-[(5-methylthiophen-2-yl)methylidene]-1,3-dioxoisoquinolin-2-yl]propanoate Traditional Name: 3-[(4Z)-1,3-diketo-4-[(5-methyl-2-thienyl)methylene]-2-isoquinolyl]propionate Formula: C18H14NO4S- MolecularWeight: 340.37306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15NO4S/c1-11-6-7-12(24-11)10-15-13-4-2-3-5-14(13)17(22)19(18(15)23)9-8-16(20)21/h2-7,10H,8-9H2,1H3,(H,20,21)/p-1/b15-10-