2-[(E)-3-(5-bromanylpyridin-3-yl)prop-2-enoyl]-5-(3-cyclopentyloxy-4-methoxy-phenyl)-1-methyl-pyrazolidin-3-one

Systemtic Name: 2-[(E)-3-(5-bromanylpyridin-3-yl)prop-2-enoyl]-5-(3-cyclopentyloxy-4-methoxy-phenyl)-1-methyl-pyrazolidin-3-one Openeye Name: 2-[(E)-3-(5-bromo-3-pyridyl)prop-2-enoyl]-5-[3-(cyclopentoxy)-4-methoxy-phenyl]-1-methyl-pyrazolidin-3-one CAS Name: 2-[(E)-3-(5-bromo-3-pyridinyl)-1-oxoprop-2-enyl]-5-(3-cyclopentyloxy-4-methoxyphenyl)-1-methyl-3-pyrazolidinone IUPAC Name: 2-[(E)-3-(5-bromopyridin-3-yl)prop-2-enoyl]-5-(3-cyclopentyloxy-4-methoxyphenyl)-1-methylpyrazolidin-3-one Traditional Name: 2-[(E)-3-(5-bromo-3-pyridyl)acryloyl]-5-[3-(cyclopentoxy)-4-methoxy-phenyl]-1-methyl-pyrazolidin-3-one Formula: C24H26BrN3O4 MolecularWeight: 500.38494

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(CC(=O)N1C(=O)C=CC2=CC(=CN=C2)Br)C3=CC(=C(C=C3)OC)OC4CCCC4

Isomeric SMILES

CN1C(CC(=O)N1C(=O)/C=C/C2=CC(=CN=C2)Br)C3=CC(=C(C=C3)OC)OC4CCCC4

InChI

InChI=1S/C24H26BrN3O4/c1-27-20(17-8-9-21(31-2)22(12-17)32-19-5-3-4-6-19)13-24(30)28(27)23(29)10-7-16-11-18(25)15-26-14-16/h7-12,14-15,19-20H,3-6,13H2,1-2H3/b10-7+