2-[7-methoxy-2-(3-methylthiophen-2-yl)-4-oxidanylidene-1,3-dihydrophthalazin-1-yl]ethanoic acid

Systemtic Name: 2-[7-methoxy-2-(3-methylthiophen-2-yl)-4-oxidanylidene-1,3-dihydrophthalazin-1-yl]ethanoic acid Openeye Name: 2-[7-methoxy-2-(3-methyl-2-thienyl)-4-oxo-1,3-dihydrophthalazin-1-yl]acetic acid CAS Name: 2-[7-methoxy-2-(3-methyl-2-thiophenyl)-4-oxo-1,3-dihydrophthalazin-1-yl]acetic acid IUPAC Name: 2-[7-methoxy-2-(3-methylthiophen-2-yl)-4-oxo-1,3-dihydrophthalazin-1-yl]acetic acid Traditional Name: 2-[4-keto-7-methoxy-2-(3-methyl-2-thienyl)-1,3-dihydrophthalazin-1-yl]acetic acid Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)N2C(C3=C(C=CC(=C3)OC)C(=O)N2)CC(=O)O

Isomeric SMILES

CC1=C(SC=C1)N2C(C3=C(C=CC(=C3)OC)C(=O)N2)CC(=O)O

InChI

InChI=1S/C16H16N2O4S/c1-9-5-6-23-16(9)18-13(8-14(19)20)12-7-10(22-2)3-4-11(12)15(21)17-18/h3-7,13H,8H2,1-2H3,(H,17,21)(H,19,20)