4-methoxy-N-[2-oxidanylidene-2-(4-pentanoylpiperazin-1-yl)ethyl]quinoline-2-carboxamide

Systemtic Name: 4-methoxy-N-[2-oxidanylidene-2-(4-pentanoylpiperazin-1-yl)ethyl]quinoline-2-carboxamide Openeye Name: 4-methoxy-N-[2-oxo-2-(4-pentanoylpiperazin-1-yl)ethyl]quinoline-2-carboxamide CAS Name: 4-methoxy-N-[2-oxo-2-[4-(1-oxopentyl)-1-piperazinyl]ethyl]-2-quinolinecarboxamide IUPAC Name: 4-methoxy-N-[2-oxo-2-(4-pentanoylpiperazin-1-yl)ethyl]quinoline-2-carboxamide Traditional Name: N-[2-keto-2-(4-valerylpiperazino)ethyl]-4-methoxy-quinaldamide Formula: C22H28N4O4 MolecularWeight: 412.48212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CCN(CC1)C(=O)CNC(=O)C2=NC3=CC=CC=C3C(=C2)OC

Isomeric SMILES

CCCCC(=O)N1CCN(CC1)C(=O)CNC(=O)C2=NC3=CC=CC=C3C(=C2)OC

InChI

InChI=1S/C22H28N4O4/c1-3-4-9-20(27)25-10-12-26(13-11-25)21(28)15-23-22(29)18-14-19(30-2)16-7-5-6-8-17(16)24-18/h5-8,14H,3-4,9-13,15H2,1-2H3,(H,23,29)