3-(carboxymethyl)-2,10b-dihydro-1H-pyrrolo[2,1-a]phthalazine-1,2,3-tricarboxylic acid

Systemtic Name: 3-(carboxymethyl)-2,10b-dihydro-1H-pyrrolo[2,1-a]phthalazine-1,2,3-tricarboxylic acid Openeye Name: 3-(carboxymethyl)-2,10b-dihydro-1H-pyrrolo[2,1-a]phthalazine-1,2,3-tricarboxylic acid CAS Name: 3-(carboxymethyl)-2,10b-dihydro-1H-pyrrolo[2,1-a]phthalazine-1,2,3-tricarboxylic acid IUPAC Name: 3-(carboxymethyl)-2,10b-dihydro-1H-pyrrolo[2,1-a]phthalazine-1,2,3-tricarboxylic acid Traditional Name: 3-(carboxymethyl)-2,10b-dihydro-1H-pyrrolo[2,1-a]phthalazine-1,2,3-tricarboxylic acid Formula: C16H14N2O8 MolecularWeight: 362.29096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C3C(C(C(N3N=CC2=C1)(CC(=O)O)C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C3C(C(C(N3N=CC2=C1)(CC(=O)O)C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C16H14N2O8/c19-9(20)5-16(15(25)26)11(14(23)24)10(13(21)22)12-8-4-2-1-3-7(8)6-17-18(12)16/h1-4,6,10-12H,5H2,(H,19,20)(H,21,22)(H,23,24)(H,25,26)