[4-[(E)-1-[4-(2-oxidanyl-3-pyrrolidin-1-yl-propoxy)phenyl]-2-phenyl-but-1-enyl]phenyl] ethanoate

Systemtic Name: [4-[(E)-1-[4-(2-oxidanyl-3-pyrrolidin-1-yl-propoxy)phenyl]-2-phenyl-but-1-enyl]phenyl] ethanoate Openeye Name: [4-[(E)-1-[4-(2-hydroxy-3-pyrrolidin-1-yl-propoxy)phenyl]-2-phenyl-but-1-enyl]phenyl] acetate CAS Name: acetic acid [4-[(E)-1-[4-[2-hydroxy-3-(1-pyrrolidinyl)propoxy]phenyl]-2-phenylbut-1-enyl]phenyl] ester IUPAC Name: [4-[(E)-1-[4-(2-hydroxy-3-pyrrolidin-1-ylpropoxy)phenyl]-2-phenylbut-1-enyl]phenyl] acetate Traditional Name: acetic acid [4-[(E)-1-[4-(2-hydroxy-3-pyrrolidino-propoxy)phenyl]-2-phenyl-but-1-enyl]phenyl] ester Formula: C31H35NO4 MolecularWeight: 485.6139

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C1=CC=C(C=C1)OCC(CN2CCCC2)O)C3=CC=C(C=C3)OC(=O)C)C4=CC=CC=C4

Isomeric SMILES

CC/C(=C(/C1=CC=C(C=C1)OCC(CN2CCCC2)O)\C3=CC=C(C=C3)OC(=O)C)/C4=CC=CC=C4

InChI

InChI=1S/C31H35NO4/c1-3-30(24-9-5-4-6-10-24)31(26-13-17-29(18-14-26)36-23(2)33)25-11-15-28(16-12-25)35-22-27(34)21-32-19-7-8-20-32/h4-6,9-18,27,34H,3,7-8,19-22H2,1-2H3/b31-30+