(E)-3-(1,3-benzodioxol-5-yl)-2-phenyl-1-[4-(1-pyrrolidin-1-ylethoxy)phenyl]prop-2-en-1-one

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-2-phenyl-1-[4-(1-pyrrolidin-1-ylethoxy)phenyl]prop-2-en-1-one Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-2-phenyl-1-[4-(1-pyrrolidin-1-ylethoxy)phenyl]prop-2-en-1-one CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-phenyl-1-[4-[1-(1-pyrrolidinyl)ethoxy]phenyl]-2-propen-1-one IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-2-phenyl-1-[4-(1-pyrrolidin-1-ylethoxy)phenyl]prop-2-en-1-one Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-2-phenyl-1-[4-(1-pyrrolidinoethoxy)phenyl]prop-2-en-1-one Formula: C28H27NO4 MolecularWeight: 441.51828

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Descriptors Computed from Structure

Canonical SMILES:

CC(N1CCCC1)OC2=CC=C(C=C2)C(=O)C(=CC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5

Isomeric SMILES

CC(N1CCCC1)OC2=CC=C(C=C2)C(=O)/C(=C/C3=CC4=C(C=C3)OCO4)/C5=CC=CC=C5

InChI

InChI=1S/C28H27NO4/c1-20(29-15-5-6-16-29)33-24-12-10-23(11-13-24)28(30)25(22-7-3-2-4-8-22)17-21-9-14-26-27(18-21)32-19-31-26/h2-4,7-14,17-18,20H,5-6,15-16,19H2,1H3/b25-17+