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

Systemtic Name: N-butyl-1,3-bis(oxidanylidene)-2-(pyridin-4-ylmethyl)isoindole-5-carboxamide Openeye Name: N-butyl-1,3-dioxo-2-(4-pyridylmethyl)isoindoline-5-carboxamide CAS Name: N-butyl-1,3-dioxo-2-(pyridin-4-ylmethyl)-5-isoindolecarboxamide IUPAC Name: N-butyl-1,3-dioxo-2-(pyridin-4-ylmethyl)isoindole-5-carboxamide Traditional Name: N-butyl-1,3-diketo-2-(4-pyridylmethyl)isoindoline-5-carboxamide Formula: C19H19N3O3 MolecularWeight: 337.37246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CC3=CC=NC=C3

Isomeric SMILES

CCCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CC3=CC=NC=C3

InChI

InChI=1S/C19H19N3O3/c1-2-3-8-21-17(23)14-4-5-15-16(11-14)19(25)22(18(15)24)12-13-6-9-20-10-7-13/h4-7,9-11H,2-3,8,12H2,1H3,(H,21,23)