2-[(E)-but-2-enoyl]-1,5,5-tris(phenylmethyl)pyrazolidin-3-one

Systemtic Name: 2-[(E)-but-2-enoyl]-1,5,5-tris(phenylmethyl)pyrazolidin-3-one Openeye Name: 1,5,5-tribenzyl-2-[(E)-but-2-enoyl]pyrazolidin-3-one CAS Name: 2-[(E)-1-oxobut-2-enyl]-1,5,5-tris(phenylmethyl)-3-pyrazolidinone IUPAC Name: 1,5,5-tribenzyl-2-[(E)-but-2-enoyl]pyrazolidin-3-one Traditional Name: 1,5,5-tribenzyl-2-[(E)-but-2-enoyl]pyrazolidin-3-one Formula: C28H28N2O2 MolecularWeight: 424.53412

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)N1C(=O)CC(N1CC2=CC=CC=C2)(CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C/C=C/C(=O)N1C(=O)CC(N1CC2=CC=CC=C2)(CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C28H28N2O2/c1-2-12-26(31)30-27(32)21-28(19-23-13-6-3-7-14-23,20-24-15-8-4-9-16-24)29(30)22-25-17-10-5-11-18-25/h2-18H,19-22H2,1H3/b12-2+