1,3-bis(oxidanylidene)-N-[2-(phenylmethyl)phenyl]-2-(pyridin-4-ylmethyl)isoindole-5-carboxamide

Systemtic Name: 1,3-bis(oxidanylidene)-N-[2-(phenylmethyl)phenyl]-2-(pyridin-4-ylmethyl)isoindole-5-carboxamide Openeye Name: N-(2-benzylphenyl)-1,3-dioxo-2-(4-pyridylmethyl)isoindoline-5-carboxamide CAS Name: 1,3-dioxo-N-[2-(phenylmethyl)phenyl]-2-(pyridin-4-ylmethyl)-5-isoindolecarboxamide IUPAC Name: N-(2-benzylphenyl)-1,3-dioxo-2-(pyridin-4-ylmethyl)isoindole-5-carboxamide Traditional Name: N-(2-benzylphenyl)-1,3-diketo-2-(4-pyridylmethyl)isoindoline-5-carboxamide Formula: C28H21N3O3 MolecularWeight: 447.48464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC5=CC=NC=C5

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)CC5=CC=NC=C5

InChI

InChI=1S/C28H21N3O3/c32-26(30-25-9-5-4-8-21(25)16-19-6-2-1-3-7-19)22-10-11-23-24(17-22)28(34)31(27(23)33)18-20-12-14-29-15-13-20/h1-15,17H,16,18H2,(H,30,32)