6-pyridin-4-yl-5-[4-(quinolin-2-ylmethoxy)phenyl]-7-oxaspiro[2.4]hept-5-en-4-one

Systemtic Name: 6-pyridin-4-yl-5-[4-(quinolin-2-ylmethoxy)phenyl]-7-oxaspiro[2.4]hept-5-en-4-one Openeye Name: 6-(4-pyridyl)-5-[4-(2-quinolylmethoxy)phenyl]-7-oxaspiro[2.4]hept-5-en-4-one CAS Name: 6-pyridin-4-yl-5-[4-(2-quinolinylmethoxy)phenyl]-7-oxaspiro[2.4]hept-5-en-4-one IUPAC Name: 6-pyridin-4-yl-5-[4-(quinolin-2-ylmethoxy)phenyl]-7-oxaspiro[2.4]hept-5-en-4-one Traditional Name: 6-(4-pyridyl)-5-[4-(2-quinolylmethoxy)phenyl]-7-oxaspiro[2.4]hept-5-en-4-one Formula: C27H20N2O3 MolecularWeight: 420.4593

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Descriptors Computed from Structure

Canonical SMILES:

C1CC12C(=O)C(=C(O2)C3=CC=NC=C3)C4=CC=C(C=C4)OCC5=NC6=CC=CC=C6C=C5

Isomeric SMILES

C1CC12C(=O)C(=C(O2)C3=CC=NC=C3)C4=CC=C(C=C4)OCC5=NC6=CC=CC=C6C=C5

InChI

InChI=1S/C27H20N2O3/c30-26-24(25(32-27(26)13-14-27)20-11-15-28-16-12-20)19-6-9-22(10-7-19)31-17-21-8-5-18-3-1-2-4-23(18)29-21/h1-12,15-16H,13-14,17H2