4-[(4-methoxyquinolin-2-yl)carbonylamino]-5-[4-(3-methylphenyl)piperazin-1-yl]-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-[(4-methoxyquinolin-2-yl)carbonylamino]-5-[4-(3-methylphenyl)piperazin-1-yl]-5-oxidanylidene-pentanoic acid Openeye Name: 4-[(4-methoxyquinoline-2-carbonyl)amino]-5-[4-(m-tolyl)piperazin-1-yl]-5-oxo-pentanoic acid CAS Name: 4-[[(4-methoxy-2-quinolinyl)-oxomethyl]amino]-5-[4-(3-methylphenyl)-1-piperazinyl]-5-oxopentanoic acid IUPAC Name: 4-[(4-methoxyquinoline-2-carbonyl)amino]-5-[4-(3-methylphenyl)piperazin-1-yl]-5-oxopentanoic acid Traditional Name: 5-keto-4-[(4-methoxyquinoline-2-carbonyl)amino]-5-[4-(m-tolyl)piperazino]valeric acid Formula: C27H30N4O5 MolecularWeight: 490.5509

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C(CCC(=O)O)NC(=O)C3=NC4=CC=CC=C4C(=C3)OC

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C(CCC(=O)O)NC(=O)C3=NC4=CC=CC=C4C(=C3)OC

InChI

InChI=1S/C27H30N4O5/c1-18-6-5-7-19(16-18)30-12-14-31(15-13-30)27(35)22(10-11-25(32)33)29-26(34)23-17-24(36-2)20-8-3-4-9-21(20)28-23/h3-9,16-17,22H,10-15H2,1-2H3,(H,29,34)(H,32,33)