1-[4-[2-(2,3-dihydro-1H-inden-2-ylmethyl)-1-oxidanyl-3-pyrrol-1-yl-propyl]-2,6-dimethoxy-phenyl]ethanone

Systemtic Name: 1-[4-[2-(2,3-dihydro-1H-inden-2-ylmethyl)-1-oxidanyl-3-pyrrol-1-yl-propyl]-2,6-dimethoxy-phenyl]ethanone Openeye Name: 1-[4-[1-hydroxy-2-(indan-2-ylmethyl)-3-pyrrol-1-yl-propyl]-2,6-dimethoxy-phenyl]ethanone CAS Name: 1-[4-[2-(2,3-dihydro-1H-inden-2-ylmethyl)-1-hydroxy-3-(1-pyrrolyl)propyl]-2,6-dimethoxyphenyl]ethanone IUPAC Name: 1-[4-[2-(2,3-dihydro-1H-inden-2-ylmethyl)-1-hydroxy-3-pyrrol-1-ylpropyl]-2,6-dimethoxyphenyl]ethanone Traditional Name: 1-[4-[1-hydroxy-2-(indan-2-ylmethyl)-3-pyrrol-1-yl-propyl]-2,6-dimethoxy-phenyl]ethanone Formula: C27H31NO4 MolecularWeight: 433.53934

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C(C=C1OC)C(C(CC2CC3=CC=CC=C3C2)CN4C=CC=C4)O)OC

Isomeric SMILES

CC(=O)C1=C(C=C(C=C1OC)C(C(CC2CC3=CC=CC=C3C2)CN4C=CC=C4)O)OC

InChI

InChI=1S/C27H31NO4/c1-18(29)26-24(31-2)15-22(16-25(26)32-3)27(30)23(17-28-10-6-7-11-28)14-19-12-20-8-4-5-9-21(20)13-19/h4-11,15-16,19,23,27,30H,12-14,17H2,1-3H3