(3-bromophenyl) (E)-2-methyl-3-[3-(oxan-2-yloxy)pyrrolidin-1-yl]prop-2-enoate

Systemtic Name: (3-bromophenyl) (E)-2-methyl-3-[3-(oxan-2-yloxy)pyrrolidin-1-yl]prop-2-enoate Openeye Name: (3-bromophenyl) (E)-2-methyl-3-(3-tetrahydropyran-2-yloxypyrrolidin-1-yl)prop-2-enoate CAS Name: (E)-2-methyl-3-[3-(2-oxanyloxy)-1-pyrrolidinyl]-2-propenoic acid (3-bromophenyl) ester IUPAC Name: (3-bromophenyl) (E)-2-methyl-3-[3-(oxan-2-yloxy)pyrrolidin-1-yl]prop-2-enoate Traditional Name: (E)-2-methyl-3-(3-tetrahydropyran-2-yloxypyrrolidino)acrylic acid (3-bromophenyl) ester Formula: C19H24BrNO4 MolecularWeight: 410.30216

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CN1CCC(C1)OC2CCCCO2)C(=O)OC3=CC(=CC=C3)Br

Isomeric SMILES

C/C(=C\N1CCC(C1)OC2CCCCO2)/C(=O)OC3=CC(=CC=C3)Br

InChI

InChI=1S/C19H24BrNO4/c1-14(19(22)25-16-6-4-5-15(20)11-16)12-21-9-8-17(13-21)24-18-7-2-3-10-23-18/h4-6,11-12,17-18H,2-3,7-10,13H2,1H3/b14-12+