5-methoxy-3-[2-oxidanylidene-2-[4-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]ethyl]-2,3-dihydroinden-1-one

Systemtic Name: 5-methoxy-3-[2-oxidanylidene-2-[4-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]ethyl]-2,3-dihydroinden-1-one Openeye Name: 5-methoxy-3-[2-oxo-2-[4-[1-(2-pyridylmethyl)imidazol-2-yl]-1-piperidyl]ethyl]indan-1-one CAS Name: 5-methoxy-3-[2-oxo-2-[4-[1-(2-pyridinylmethyl)-2-imidazolyl]-1-piperidinyl]ethyl]-2,3-dihydroinden-1-one IUPAC Name: 5-methoxy-3-[2-oxo-2-[4-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]ethyl]-2,3-dihydroinden-1-one Traditional Name: 3-[2-keto-2-[4-[1-(2-pyridylmethyl)imidazol-2-yl]piperidino]ethyl]-5-methoxy-indan-1-one Formula: C26H28N4O3 MolecularWeight: 444.52552

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=O)CC2CC(=O)N3CCC(CC3)C4=NC=CN4CC5=CC=CC=N5

Isomeric SMILES

COC1=CC2=C(C=C1)C(=O)CC2CC(=O)N3CCC(CC3)C4=NC=CN4CC5=CC=CC=N5

InChI

InChI=1S/C26H28N4O3/c1-33-21-5-6-22-23(16-21)19(14-24(22)31)15-25(32)29-11-7-18(8-12-29)26-28-10-13-30(26)17-20-4-2-3-9-27-20/h2-6,9-10,13,16,18-19H,7-8,11-12,14-15,17H2,1H3