methyl 4-[(4-methoxyquinolin-2-yl)carbonylamino]-5-oxidanylidene-5-piperazin-1-yl-pentanoate

Systemtic Name: methyl 4-[(4-methoxyquinolin-2-yl)carbonylamino]-5-oxidanylidene-5-piperazin-1-yl-pentanoate Openeye Name: methyl 4-[(4-methoxyquinoline-2-carbonyl)amino]-5-oxo-5-piperazin-1-yl-pentanoate CAS Name: 4-[[(4-methoxy-2-quinolinyl)-oxomethyl]amino]-5-oxo-5-(1-piperazinyl)pentanoic acid methyl ester IUPAC Name: methyl 4-[(4-methoxyquinoline-2-carbonyl)amino]-5-oxo-5-piperazin-1-ylpentanoate Traditional Name: 5-keto-4-[(4-methoxyquinoline-2-carbonyl)amino]-5-piperazino-valeric acid methyl ester Formula: C21H26N4O5 MolecularWeight: 414.45494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4O5/c1-29-18-13-17(23-15-6-4-3-5-14(15)18)20(27)24-16(7-8-19(26)30-2)21(28)25-11-9-22-10-12-25/h3-6,13,16,22H,7-12H2,1-2H3,(H,24,27)