ethyl 6-[2-(4-methoxyquinolin-2-yl)carbonylpyrazolidin-1-yl]-6-oxidanylidene-hexanoate

Systemtic Name: ethyl 6-[2-(4-methoxyquinolin-2-yl)carbonylpyrazolidin-1-yl]-6-oxidanylidene-hexanoate Openeye Name: ethyl 6-[2-(4-methoxyquinoline-2-carbonyl)pyrazolidin-1-yl]-6-oxo-hexanoate CAS Name: 6-[2-[(4-methoxy-2-quinolinyl)-oxomethyl]-1-pyrazolidinyl]-6-oxohexanoic acid ethyl ester IUPAC Name: ethyl 6-[2-(4-methoxyquinoline-2-carbonyl)pyrazolidin-1-yl]-6-oxohexanoate Traditional Name: 6-keto-6-[2-(4-methoxyquinoline-2-carbonyl)pyrazolidin-1-yl]hexanoic acid ethyl ester Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCC(=O)N1CCCN1C(=O)C2=NC3=CC=CC=C3C(=C2)OC

Isomeric SMILES

CCOC(=O)CCCCC(=O)N1CCCN1C(=O)C2=NC3=CC=CC=C3C(=C2)OC

InChI

InChI=1S/C22H27N3O5/c1-3-30-21(27)12-7-6-11-20(26)24-13-8-14-25(24)22(28)18-15-19(29-2)16-9-4-5-10-17(16)23-18/h4-5,9-10,15H,3,6-8,11-14H2,1-2H3