2-[4-[4-(3-oxidanyl-5-pyridin-3-yl-pentan-2-yl)oxyphenyl]phenyl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-[4-(3-oxidanyl-5-pyridin-3-yl-pentan-2-yl)oxyphenyl]phenyl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-[4-[2-hydroxy-1-methyl-4-(3-pyridyl)butoxy]phenyl]phenyl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[4-[3-hydroxy-5-(3-pyridinyl)pentan-2-yl]oxyphenyl]phenyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-[4-(3-hydroxy-5-pyridin-3-ylpentan-2-yl)oxyphenyl]phenyl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-[4-[2-hydroxy-1-methyl-4-(3-pyridyl)butoxy]phenyl]phenyl]-1-pyrrolidino-ethanone Formula: C28H32N2O3 MolecularWeight: 444.56528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCC1=CN=CC=C1)O)OC2=CC=C(C=C2)C3=CC=C(C=C3)CC(=O)N4CCCC4

Isomeric SMILES

CC(C(CCC1=CN=CC=C1)O)OC2=CC=C(C=C2)C3=CC=C(C=C3)CC(=O)N4CCCC4

InChI

InChI=1S/C28H32N2O3/c1-21(27(31)15-8-23-5-4-16-29-20-23)33-26-13-11-25(12-14-26)24-9-6-22(7-10-24)19-28(32)30-17-2-3-18-30/h4-7,9-14,16,20-21,27,31H,2-3,8,15,17-19H2,1H3