2-(4-bromophenyl)-1,3-bis(oxidanylidene)-N-(pyridin-4-ylmethyl)isoindole-5-carboxamide

Systemtic Name: 2-(4-bromophenyl)-1,3-bis(oxidanylidene)-N-(pyridin-4-ylmethyl)isoindole-5-carboxamide Openeye Name: 2-(4-bromophenyl)-1,3-dioxo-N-(4-pyridylmethyl)isoindoline-5-carboxamide CAS Name: 2-(4-bromophenyl)-1,3-dioxo-N-(pyridin-4-ylmethyl)-5-isoindolecarboxamide IUPAC Name: 2-(4-bromophenyl)-1,3-dioxo-N-(pyridin-4-ylmethyl)isoindole-5-carboxamide Traditional Name: 2-(4-bromophenyl)-1,3-diketo-N-(4-pyridylmethyl)isoindoline-5-carboxamide Formula: C21H14BrN3O3 MolecularWeight: 436.25816

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCC4=CC=NC=C4)Br

Isomeric SMILES

C1=CC(=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCC4=CC=NC=C4)Br

InChI

InChI=1S/C21H14BrN3O3/c22-15-2-4-16(5-3-15)25-20(27)17-6-1-14(11-18(17)21(25)28)19(26)24-12-13-7-9-23-10-8-13/h1-11H,12H2,(H,24,26)