4-methoxy-3-[2-oxidanylidene-2-[4-(phenylcarbonyl)piperazin-1-yl]ethanoyl]-1H-pyrrolo[2,3-c]pyridine-7-carbonitrile

Systemtic Name: 4-methoxy-3-[2-oxidanylidene-2-[4-(phenylcarbonyl)piperazin-1-yl]ethanoyl]-1H-pyrrolo[2,3-c]pyridine-7-carbonitrile Openeye Name: 3-[2-(4-benzoylpiperazin-1-yl)-2-oxo-acetyl]-4-methoxy-1H-pyrrolo[2,3-c]pyridine-7-carbonitrile CAS Name: 3-[2-(4-benzoyl-1-piperazinyl)-1,2-dioxoethyl]-4-methoxy-1H-pyrrolo[2,3-c]pyridine-7-carbonitrile IUPAC Name: 3-[2-(4-benzoylpiperazin-1-yl)-2-oxoacetyl]-4-methoxy-1H-pyrrolo[2,3-c]pyridine-7-carbonitrile Traditional Name: 3-[2-(4-benzoylpiperazino)-2-keto-acetyl]-4-methoxy-1H-pyrrolo[2,3-c]pyridine-7-carbonitrile Formula: C22H19N5O4 MolecularWeight: 417.41736

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN=C(C2=C1C(=CN2)C(=O)C(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4)C#N

Isomeric SMILES

COC1=CN=C(C2=C1C(=CN2)C(=O)C(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4)C#N

InChI

InChI=1S/C22H19N5O4/c1-31-17-13-24-16(11-23)19-18(17)15(12-25-19)20(28)22(30)27-9-7-26(8-10-27)21(29)14-5-3-2-4-6-14/h2-6,12-13,25H,7-10H2,1H3