4-[[5,7-bis(oxidanylidene)pyrrolo[3,4-b]pyridin-6-yl]methylamino]benzoate

Systemtic Name: 4-[[5,7-bis(oxidanylidene)pyrrolo[3,4-b]pyridin-6-yl]methylamino]benzoate Openeye Name: 4-[(5,7-dioxopyrrolo[3,4-b]pyridin-6-yl)methylamino]benzoate CAS Name: 4-[(5,7-dioxo-6-pyrrolo[3,4-b]pyridinyl)methylamino]benzoate IUPAC Name: 4-[(5,7-dioxopyrrolo[3,4-b]pyridin-6-yl)methylamino]benzoate Traditional Name: 4-[(5,7-diketopyrrolo[3,4-b]pyridin-6-yl)methylamino]benzoate Formula: C15H10N3O4- MolecularWeight: 296.2576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=O)N(C2=O)CNC3=CC=C(C=C3)C(=O)[O-])N=C1

Isomeric SMILES

C1=CC2=C(C(=O)N(C2=O)CNC3=CC=C(C=C3)C(=O)[O-])N=C1

InChI

InChI=1S/C15H11N3O4/c19-13-11-2-1-7-16-12(11)14(20)18(13)8-17-10-5-3-9(4-6-10)15(21)22/h1-7,17H,8H2,(H,21,22)/p-1