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

Systemtic Name: 3-[[3-(2,3-dihydro-1H-inden-2-yloxy)-4-methoxy-phenyl]-(quinolin-2-ylmethyl)amino]cyclopent-2-en-1-one Openeye Name: 3-[3-indan-2-yloxy-4-methoxy-N-(2-quinolylmethyl)anilino]cyclopent-2-en-1-one CAS Name: 3-[3-(2,3-dihydro-1H-inden-2-yloxy)-4-methoxy-N-(2-quinolinylmethyl)anilino]-1-cyclopent-2-enone IUPAC Name: 3-[3-(2,3-dihydro-1H-inden-2-yloxy)-4-methoxy-N-(quinolin-2-ylmethyl)anilino]cyclopent-2-en-1-one Traditional Name: 3-[3-indan-2-yloxy-4-methoxy-N-(2-quinolylmethyl)anilino]cyclopent-2-en-1-one Formula: C31H28N2O3 MolecularWeight: 476.56562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CC2=NC3=CC=CC=C3C=C2)C4=CC(=O)CC4)OC5CC6=CC=CC=C6C5

Isomeric SMILES

COC1=C(C=C(C=C1)N(CC2=NC3=CC=CC=C3C=C2)C4=CC(=O)CC4)OC5CC6=CC=CC=C6C5

InChI

InChI=1S/C31H28N2O3/c1-35-30-15-13-26(19-31(30)36-28-16-22-7-2-3-8-23(22)17-28)33(25-12-14-27(34)18-25)20-24-11-10-21-6-4-5-9-29(21)32-24/h2-11,13,15,18-19,28H,12,14,16-17,20H2,1H3