5-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)-1-prop-2-enoxy-pyrrolo[3,2-b]pyridine-6-carboxylic acid

Systemtic Name: 5-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)-1-prop-2-enoxy-pyrrolo[3,2-b]pyridine-6-carboxylic acid Openeye Name: 1-allyloxy-5-(4-isopropyl-4-methyl-5-oxo-1H-imidazol-2-yl)pyrrolo[3,2-b]pyridine-6-carboxylic acid CAS Name: 5-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)-1-prop-2-enoxy-6-pyrrolo[3,2-b]pyridinecarboxylic acid IUPAC Name: 5-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)-1-prop-2-enoxypyrrolo[3,2-b]pyridine-6-carboxylic acid Traditional Name: 1-allyloxy-5-(4-isopropyl-5-keto-4-methyl-2-imidazolin-2-yl)pyrrolo[3,2-b]pyridine-6-carboxylic acid Formula: C18H20N4O4 MolecularWeight: 356.3758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(C(=O)NC(=N1)C2=NC3=C(C=C2C(=O)O)N(C=C3)OCC=C)C

Isomeric SMILES

CC(C)C1(C(=O)NC(=N1)C2=NC3=C(C=C2C(=O)O)N(C=C3)OCC=C)C

InChI

InChI=1S/C18H20N4O4/c1-5-8-26-22-7-6-12-13(22)9-11(16(23)24)14(19-12)15-20-17(25)18(4,21-15)10(2)3/h5-7,9-10H,1,8H2,2-4H3,(H,23,24)(H,20,21,25)