[2-(4-morpholin-4-ylbutoxy)phenyl] 7-chloranyl-3-pyrrolidin-1-yl-quinoline-8-carboxylate

Systemtic Name: [2-(4-morpholin-4-ylbutoxy)phenyl] 7-chloranyl-3-pyrrolidin-1-yl-quinoline-8-carboxylate Openeye Name: [2-(4-morpholinobutoxy)phenyl] 7-chloro-3-pyrrolidin-1-yl-quinoline-8-carboxylate CAS Name: 7-chloro-3-(1-pyrrolidinyl)-8-quinolinecarboxylic acid [2-[4-(4-morpholinyl)butoxy]phenyl] ester IUPAC Name: [2-(4-morpholin-4-ylbutoxy)phenyl] 7-chloro-3-pyrrolidin-1-ylquinoline-8-carboxylate Traditional Name: 7-chloro-3-pyrrolidino-quinoline-8-carboxylic acid [2-(4-morpholinobutoxy)phenyl] ester Formula: C28H32ClN3O4 MolecularWeight: 510.02438

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CN=C3C(=C2)C=CC(=C3C(=O)OC4=CC=CC=C4OCCCCN5CCOCC5)Cl

Isomeric SMILES

C1CCN(C1)C2=CN=C3C(=C2)C=CC(=C3C(=O)OC4=CC=CC=C4OCCCCN5CCOCC5)Cl

InChI

InChI=1S/C28H32ClN3O4/c29-23-10-9-21-19-22(32-12-3-4-13-32)20-30-27(21)26(23)28(33)36-25-8-2-1-7-24(25)35-16-6-5-11-31-14-17-34-18-15-31/h1-2,7-10,19-20H,3-6,11-18H2