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

Systemtic Name: 3-[[3-(2,3-dihydro-1H-inden-1-yloxy)-4-methoxy-phenyl]-(phenylmethyl)amino]cyclohex-2-en-1-one Openeye Name: 3-(N-benzyl-3-indan-1-yloxy-4-methoxy-anilino)cyclohex-2-en-1-one CAS Name: 3-[3-(2,3-dihydro-1H-inden-1-yloxy)-4-methoxy-N-(phenylmethyl)anilino]-1-cyclohex-2-enone IUPAC Name: 3-[N-benzyl-3-(2,3-dihydro-1H-inden-1-yloxy)-4-methoxyanilino]cyclohex-2-en-1-one Traditional Name: 3-(N-benzyl-3-indan-1-yloxy-4-methoxy-anilino)cyclohex-2-en-1-one Formula: C29H29NO3 MolecularWeight: 439.54546

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CC2=CC=CC=C2)C3=CC(=O)CCC3)OC4CCC5=CC=CC=C45

Isomeric SMILES

COC1=C(C=C(C=C1)N(CC2=CC=CC=C2)C3=CC(=O)CCC3)OC4CCC5=CC=CC=C45

InChI

InChI=1S/C29H29NO3/c1-32-28-17-15-24(19-29(28)33-27-16-14-22-10-5-6-13-26(22)27)30(20-21-8-3-2-4-9-21)23-11-7-12-25(31)18-23/h2-6,8-10,13,15,17-19,27H,7,11-12,14,16,20H2,1H3