4-methoxy-3-[2-oxidanylidene-2-(4-quinazolin-4-ylpiperazin-1-yl)ethanoyl]-1H-pyrrolo[2,3-c]pyridine-7-carboxylic acid

Systemtic Name: 4-methoxy-3-[2-oxidanylidene-2-(4-quinazolin-4-ylpiperazin-1-yl)ethanoyl]-1H-pyrrolo[2,3-c]pyridine-7-carboxylic acid Openeye Name: 4-methoxy-3-[2-oxo-2-(4-quinazolin-4-ylpiperazin-1-yl)acetyl]-1H-pyrrolo[2,3-c]pyridine-7-carboxylic acid CAS Name: 3-[1,2-dioxo-2-[4-(4-quinazolinyl)-1-piperazinyl]ethyl]-4-methoxy-1H-pyrrolo[2,3-c]pyridine-7-carboxylic acid IUPAC Name: 4-methoxy-3-[2-oxo-2-(4-quinazolin-4-ylpiperazin-1-yl)acetyl]-1H-pyrrolo[2,3-c]pyridine-7-carboxylic acid Traditional Name: 3-[2-keto-2-(4-quinazolin-4-ylpiperazino)acetyl]-4-methoxy-1H-pyrrolo[2,3-c]pyridine-7-carboxylic acid Formula: C23H20N6O5 MolecularWeight: 460.4421

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN=C(C2=C1C(=CN2)C(=O)C(=O)N3CCN(CC3)C4=NC=NC5=CC=CC=C54)C(=O)O

Isomeric SMILES

COC1=CN=C(C2=C1C(=CN2)C(=O)C(=O)N3CCN(CC3)C4=NC=NC5=CC=CC=C54)C(=O)O

InChI

InChI=1S/C23H20N6O5/c1-34-16-11-25-19(23(32)33)18-17(16)14(10-24-18)20(30)22(31)29-8-6-28(7-9-29)21-13-4-2-3-5-15(13)26-12-27-21/h2-5,10-12,24H,6-9H2,1H3,(H,32,33)