3-[[3-(2,3-dihydro-1H-inden-1-yloxy)-4-methoxy-phenyl]-(pyridin-2-ylmethyl)amino]cyclohex-2-en-1-one

Systemtic Name: 3-[[3-(2,3-dihydro-1H-inden-1-yloxy)-4-methoxy-phenyl]-(pyridin-2-ylmethyl)amino]cyclohex-2-en-1-one Openeye Name: 3-[3-indan-1-yloxy-4-methoxy-N-(2-pyridylmethyl)anilino]cyclohex-2-en-1-one CAS Name: 3-[3-(2,3-dihydro-1H-inden-1-yloxy)-4-methoxy-N-(2-pyridinylmethyl)anilino]-1-cyclohex-2-enone IUPAC Name: 3-[3-(2,3-dihydro-1H-inden-1-yloxy)-4-methoxy-N-(pyridin-2-ylmethyl)anilino]cyclohex-2-en-1-one Traditional Name: 3-[3-indan-1-yloxy-4-methoxy-N-(2-pyridylmethyl)anilino]cyclohex-2-en-1-one Formula: C28H28N2O3 MolecularWeight: 440.53352

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CC2=CC=CC=N2)C3=CC(=O)CCC3)OC4CCC5=CC=CC=C45

Isomeric SMILES

COC1=C(C=C(C=C1)N(CC2=CC=CC=N2)C3=CC(=O)CCC3)OC4CCC5=CC=CC=C45

InChI

InChI=1S/C28H28N2O3/c1-32-27-15-13-23(18-28(27)33-26-14-12-20-7-2-3-11-25(20)26)30(19-21-8-4-5-16-29-21)22-9-6-10-24(31)17-22/h2-5,7-8,11,13,15-18,26H,6,9-10,12,14,19H2,1H3