2-[[1,4-bis(oxidanylidene)-2,3-dihydrophthalazin-6-yl]carbamoyl]benzoic acid

Systemtic Name: 2-[[1,4-bis(oxidanylidene)-2,3-dihydrophthalazin-6-yl]carbamoyl]benzoic acid Openeye Name: 2-[(1,4-dioxo-2,3-dihydrophthalazin-6-yl)carbamoyl]benzoic acid CAS Name: 2-[[(1,4-dioxo-2,3-dihydrophthalazin-6-yl)amino]-oxomethyl]benzoic acid IUPAC Name: 2-[(1,4-dioxo-2,3-dihydrophthalazin-6-yl)carbamoyl]benzoic acid Traditional Name: 2-[(1,4-diketo-2,3-dihydrophthalazin-6-yl)carbamoyl]benzoic acid Formula: C16H11N3O5 MolecularWeight: 325.27564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC3=C(C=C2)C(=O)NNC3=O)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC3=C(C=C2)C(=O)NNC3=O)C(=O)O

InChI

InChI=1S/C16H11N3O5/c20-13(9-3-1-2-4-11(9)16(23)24)17-8-5-6-10-12(7-8)15(22)19-18-14(10)21/h1-7H,(H,17,20)(H,18,21)(H,19,22)(H,23,24)