5-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]-3-methyl-thiophene-2-carboxylate

Systemtic Name: 5-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]-3-methyl-thiophene-2-carboxylate Openeye Name: 5-(1,3-dioxo-4H-isoquinolin-2-yl)-3-methyl-thiophene-2-carboxylate CAS Name: 5-(1,3-dioxo-4H-isoquinolin-2-yl)-3-methyl-2-thiophenecarboxylate IUPAC Name: 5-(1,3-dioxo-4H-isoquinolin-2-yl)-3-methylthiophene-2-carboxylate Traditional Name: 5-(1,3-diketo-4H-isoquinolin-2-yl)-3-methyl-2-thenoate Formula: C15H10NO4S- MolecularWeight: 300.3092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)N2C(=O)CC3=CC=CC=C3C2=O)C(=O)[O-]

Isomeric SMILES

CC1=C(SC(=C1)N2C(=O)CC3=CC=CC=C3C2=O)C(=O)[O-]

InChI

InChI=1S/C15H11NO4S/c1-8-6-12(21-13(8)15(19)20)16-11(17)7-9-4-2-3-5-10(9)14(16)18/h2-6H,7H2,1H3,(H,19,20)/p-1