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

Systemtic Name: 4-pyridin-4-yl-5-[4-(quinolin-2-ylmethoxy)phenyl]-7-azaspiro[2.4]hept-4-en-6-one Openeye Name: 4-(4-pyridyl)-5-[4-(2-quinolylmethoxy)phenyl]-7-azaspiro[2.4]hept-4-en-6-one CAS Name: 4-pyridin-4-yl-5-[4-(2-quinolinylmethoxy)phenyl]-7-azaspiro[2.4]hept-4-en-6-one IUPAC Name: 4-pyridin-4-yl-5-[4-(quinolin-2-ylmethoxy)phenyl]-7-azaspiro[2.4]hept-4-en-6-one Traditional Name: 4-(4-pyridyl)-5-[4-(2-quinolylmethoxy)phenyl]-7-azaspiro[2.4]hept-4-en-6-one Formula: C27H21N3O2 MolecularWeight: 419.47454

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Descriptors Computed from Structure

Canonical SMILES:

C1CC12C(=C(C(=O)N2)C3=CC=C(C=C3)OCC4=NC5=CC=CC=C5C=C4)C6=CC=NC=C6

Isomeric SMILES

C1CC12C(=C(C(=O)N2)C3=CC=C(C=C3)OCC4=NC5=CC=CC=C5C=C4)C6=CC=NC=C6

InChI

InChI=1S/C27H21N3O2/c31-26-24(25(27(30-26)13-14-27)20-11-15-28-16-12-20)19-6-9-22(10-7-19)32-17-21-8-5-18-3-1-2-4-23(18)29-21/h1-12,15-16H,13-14,17H2,(H,30,31)