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

Systemtic Name: 3-[[3-(2,3-dihydro-1H-inden-2-yloxy)-4-methoxy-phenyl]-(pyridin-4-ylmethyl)amino]cyclopent-2-en-1-one Openeye Name: 3-[3-indan-2-yloxy-4-methoxy-N-(4-pyridylmethyl)anilino]cyclopent-2-en-1-one CAS Name: 3-[3-(2,3-dihydro-1H-inden-2-yloxy)-4-methoxy-N-(pyridin-4-ylmethyl)anilino]-1-cyclopent-2-enone IUPAC Name: 3-[3-(2,3-dihydro-1H-inden-2-yloxy)-4-methoxy-N-(pyridin-4-ylmethyl)anilino]cyclopent-2-en-1-one Traditional Name: 3-[3-indan-2-yloxy-4-methoxy-N-(4-pyridylmethyl)anilino]cyclopent-2-en-1-one Formula: C27H26N2O3 MolecularWeight: 426.50694

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CC2=CC=NC=C2)C3=CC(=O)CC3)OC4CC5=CC=CC=C5C4

Isomeric SMILES

COC1=C(C=C(C=C1)N(CC2=CC=NC=C2)C3=CC(=O)CC3)OC4CC5=CC=CC=C5C4

InChI

InChI=1S/C27H26N2O3/c1-31-26-9-7-23(17-27(26)32-25-14-20-4-2-3-5-21(20)15-25)29(22-6-8-24(30)16-22)18-19-10-12-28-13-11-19/h2-5,7,9-13,16-17,25H,6,8,14-15,18H2,1H3