4-[[5-[5-(7-chloranylquinolin-4-yl)oxypentoxy]-4-oxidanylidene-pyran-2-yl]methyl]piperazine-1-carboxylate

Systemtic Name: 4-[[5-[5-(7-chloranylquinolin-4-yl)oxypentoxy]-4-oxidanylidene-pyran-2-yl]methyl]piperazine-1-carboxylate Openeye Name: 4-[[5-[5-[(7-chloro-4-quinolyl)oxy]pentoxy]-4-oxo-pyran-2-yl]methyl]piperazine-1-carboxylate CAS Name: 4-[[5-[5-[(7-chloro-4-quinolinyl)oxy]pentoxy]-4-oxo-2-pyranyl]methyl]-1-piperazinecarboxylate IUPAC Name: 4-[[5-[5-(7-chloroquinolin-4-yl)oxypentoxy]-4-oxopyran-2-yl]methyl]piperazine-1-carboxylate Traditional Name: 4-[[5-[5-[(7-chloro-4-quinolyl)oxy]pentoxy]-4-keto-pyran-2-yl]methyl]piperazine-1-carboxylate Formula: C25H27ClN3O6- MolecularWeight: 500.95138

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=O)C(=CO2)OCCCCCOC3=C4C=CC(=CC4=NC=C3)Cl)C(=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC(=O)C(=CO2)OCCCCCOC3=C4C=CC(=CC4=NC=C3)Cl)C(=O)[O-]

InChI

InChI=1S/C25H28ClN3O6/c26-18-4-5-20-21(14-18)27-7-6-23(20)33-12-2-1-3-13-34-24-17-35-19(15-22(24)30)16-28-8-10-29(11-9-28)25(31)32/h4-7,14-15,17H,1-3,8-13,16H2,(H,31,32)/p-1