4-[(4-methoxyquinolin-2-yl)carbonylamino]-5-oxidanylidene-5-piperazin-1-yl-pentanoic acid

Systemtic Name: 4-[(4-methoxyquinolin-2-yl)carbonylamino]-5-oxidanylidene-5-piperazin-1-yl-pentanoic acid Openeye Name: 4-[(4-methoxyquinoline-2-carbonyl)amino]-5-oxo-5-piperazin-1-yl-pentanoic acid CAS Name: 4-[[(4-methoxy-2-quinolinyl)-oxomethyl]amino]-5-oxo-5-(1-piperazinyl)pentanoic acid IUPAC Name: 4-[(4-methoxyquinoline-2-carbonyl)amino]-5-oxo-5-piperazin-1-ylpentanoic acid Traditional Name: 5-keto-4-[(4-methoxyquinoline-2-carbonyl)amino]-5-piperazino-valeric acid Formula: C20H24N4O5 MolecularWeight: 400.42836

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC2=CC=CC=C21)C(=O)NC(CCC(=O)O)C(=O)N3CCNCC3

Isomeric SMILES

COC1=CC(=NC2=CC=CC=C21)C(=O)NC(CCC(=O)O)C(=O)N3CCNCC3

InChI

InChI=1S/C20H24N4O5/c1-29-17-12-16(22-14-5-3-2-4-13(14)17)19(27)23-15(6-7-18(25)26)20(28)24-10-8-21-9-11-24/h2-5,12,15,21H,6-11H2,1H3,(H,23,27)(H,25,26)