2-azanyl-1-[2-[[bis(2-methoxyphenyl)-phenyl-methoxy]methyl]-4-oxidanyl-pyrrolidin-1-yl]-4-pyridin-2-yl-2-(2-pyridin-2-ylethyl)butan-1-one

Systemtic Name: 2-azanyl-1-[2-[[bis(2-methoxyphenyl)-phenyl-methoxy]methyl]-4-oxidanyl-pyrrolidin-1-yl]-4-pyridin-2-yl-2-(2-pyridin-2-ylethyl)butan-1-one Openeye Name: 2-amino-1-[2-[[bis(2-methoxyphenyl)-phenyl-methoxy]methyl]-4-hydroxy-pyrrolidin-1-yl]-4-(2-pyridyl)-2-[2-(2-pyridyl)ethyl]butan-1-one CAS Name: 2-amino-1-[2-[[bis(2-methoxyphenyl)-phenylmethoxy]methyl]-4-hydroxy-1-pyrrolidinyl]-4-(2-pyridinyl)-2-[2-(2-pyridinyl)ethyl]-1-butanone IUPAC Name: 2-amino-1-[2-[[bis(2-methoxyphenyl)-phenylmethoxy]methyl]-4-hydroxypyrrolidin-1-yl]-4-pyridin-2-yl-2-(2-pyridin-2-ylethyl)butan-1-one Traditional Name: 2-amino-1-[2-[[bis(2-methoxyphenyl)-phenyl-methoxy]methyl]-4-hydroxy-pyrrolidino]-4-(2-pyridyl)-2-[2-(2-pyridyl)ethyl]butan-1-one Formula: C42H46N4O5 MolecularWeight: 686.83844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(C2=CC=CC=C2)(C3=CC=CC=C3OC)OCC4CC(CN4C(=O)C(CCC5=CC=CC=N5)(CCC6=CC=CC=N6)N)O

Isomeric SMILES

COC1=CC=CC=C1C(C2=CC=CC=C2)(C3=CC=CC=C3OC)OCC4CC(CN4C(=O)C(CCC5=CC=CC=N5)(CCC6=CC=CC=N6)N)O

InChI

InChI=1S/C42H46N4O5/c1-49-38-20-8-6-18-36(38)42(31-14-4-3-5-15-31,37-19-7-9-21-39(37)50-2)51-30-34-28-35(47)29-46(34)40(48)41(43,24-22-32-16-10-12-26-44-32)25-23-33-17-11-13-27-45-33/h3-21,26-27,34-35,47H,22-25,28-30,43H2,1-2H3