[3-[4-(2-butoxyethoxy)phenyl]phenyl] (E)-4-pyrrolidin-1-ylbut-2-enoate

Systemtic Name: [3-[4-(2-butoxyethoxy)phenyl]phenyl] (E)-4-pyrrolidin-1-ylbut-2-enoate Openeye Name: [3-[4-(2-butoxyethoxy)phenyl]phenyl] (E)-4-pyrrolidin-1-ylbut-2-enoate CAS Name: (E)-4-(1-pyrrolidinyl)-2-butenoic acid [3-[4-(2-butoxyethoxy)phenyl]phenyl] ester IUPAC Name: [3-[4-(2-butoxyethoxy)phenyl]phenyl] (E)-4-pyrrolidin-1-ylbut-2-enoate Traditional Name: (E)-4-pyrrolidinobut-2-enoic acid [3-[4-(2-butoxyethoxy)phenyl]phenyl] ester Formula: C26H33NO4 MolecularWeight: 423.54452

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCOC1=CC=C(C=C1)C2=CC(=CC=C2)OC(=O)C=CCN3CCCC3

Isomeric SMILES

CCCCOCCOC1=CC=C(C=C1)C2=CC(=CC=C2)OC(=O)/C=C/CN3CCCC3

InChI

InChI=1S/C26H33NO4/c1-2-3-18-29-19-20-30-24-13-11-22(12-14-24)23-8-6-9-25(21-23)31-26(28)10-7-17-27-15-4-5-16-27/h6-14,21H,2-5,15-20H2,1H3/b10-7+