4-[3-[(3-ethenyl-1-heptyl-piperidin-4-yl)methyl]oxiran-2-yl]-6-methoxy-quinoline

Systemtic Name: 4-[3-[(3-ethenyl-1-heptyl-piperidin-4-yl)methyl]oxiran-2-yl]-6-methoxy-quinoline Openeye Name: 4-[3-[(1-heptyl-3-vinyl-4-piperidyl)methyl]oxiran-2-yl]-6-methoxy-quinoline CAS Name: 4-[3-[(3-ethenyl-1-heptyl-4-piperidinyl)methyl]-2-oxiranyl]-6-methoxyquinoline IUPAC Name: 4-[3-[(3-ethenyl-1-heptylpiperidin-4-yl)methyl]oxiran-2-yl]-6-methoxyquinoline Traditional Name: 4-[3-[(1-heptyl-3-vinyl-4-piperidyl)methyl]oxiran-2-yl]-6-methoxy-quinoline Formula: C27H38N2O2 MolecularWeight: 422.60282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1CCC(C(C1)C=C)CC2C(O2)C3=C4C=C(C=CC4=NC=C3)OC

Isomeric SMILES

CCCCCCCN1CCC(C(C1)C=C)CC2C(O2)C3=C4C=C(C=CC4=NC=C3)OC

InChI

InChI=1S/C27H38N2O2/c1-4-6-7-8-9-15-29-16-13-21(20(5-2)19-29)17-26-27(31-26)23-12-14-28-25-11-10-22(30-3)18-24(23)25/h5,10-12,14,18,20-21,26-27H,2,4,6-9,13,15-17,19H2,1,3H3