3-(1H-imidazol-5-yl)-2-[4-methyl-1,3-bis(oxidanylidene)pyrrolo[3,4-c]quinolin-2-yl]propanoic acid

Systemtic Name: 3-(1H-imidazol-5-yl)-2-[4-methyl-1,3-bis(oxidanylidene)pyrrolo[3,4-c]quinolin-2-yl]propanoic acid Openeye Name: 3-(1H-imidazol-5-yl)-2-(4-methyl-1,3-dioxo-pyrrolo[3,4-c]quinolin-2-yl)propanoic acid CAS Name: 3-(1H-imidazol-5-yl)-2-(4-methyl-1,3-dioxo-2-pyrrolo[3,4-c]quinolinyl)propanoic acid IUPAC Name: 3-(1H-imidazol-5-yl)-2-(4-methyl-1,3-dioxopyrrolo[3,4-c]quinolin-2-yl)propanoic acid Traditional Name: 2-(1,3-diketo-4-methyl-pyrrolo[3,4-c]quinolin-2-yl)-3-(1H-imidazol-5-yl)propionic acid Formula: C18H14N4O4 MolecularWeight: 350.32816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C3=C1C(=O)N(C3=O)C(CC4=CN=CN4)C(=O)O

Isomeric SMILES

CC1=NC2=CC=CC=C2C3=C1C(=O)N(C3=O)C(CC4=CN=CN4)C(=O)O

InChI

InChI=1S/C18H14N4O4/c1-9-14-15(11-4-2-3-5-12(11)21-9)17(24)22(16(14)23)13(18(25)26)6-10-7-19-8-20-10/h2-5,7-8,13H,6H2,1H3,(H,19,20)(H,25,26)