3-(3-ethyl-1-heptyl-piperidin-4-yl)-1-(6-methoxyquinolin-4-yl)propan-1-one

Systemtic Name: 3-(3-ethyl-1-heptyl-piperidin-4-yl)-1-(6-methoxyquinolin-4-yl)propan-1-one Openeye Name: 3-(3-ethyl-1-heptyl-4-piperidyl)-1-(6-methoxy-4-quinolyl)propan-1-one CAS Name: 3-(3-ethyl-1-heptyl-4-piperidinyl)-1-(6-methoxy-4-quinolinyl)-1-propanone IUPAC Name: 3-(3-ethyl-1-heptylpiperidin-4-yl)-1-(6-methoxyquinolin-4-yl)propan-1-one Traditional Name: 3-(3-ethyl-1-heptyl-4-piperidyl)-1-(6-methoxy-4-quinolyl)propan-1-one Formula: C27H40N2O2 MolecularWeight: 424.6187

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1CCC(C(C1)CC)CCC(=O)C2=C3C=C(C=CC3=NC=C2)OC

Isomeric SMILES

CCCCCCCN1CCC(C(C1)CC)CCC(=O)C2=C3C=C(C=CC3=NC=C2)OC

InChI

InChI=1S/C27H40N2O2/c1-4-6-7-8-9-17-29-18-15-22(21(5-2)20-29)10-13-27(30)24-14-16-28-26-12-11-23(31-3)19-25(24)26/h11-12,14,16,19,21-22H,4-10,13,15,17-18,20H2,1-3H3