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

Systemtic Name: 2-(3-methylbutyl)-1,3-bis(oxidanylidene)-N-(pyridin-3-ylmethyl)isoindole-5-carboxamide Openeye Name: 2-isopentyl-1,3-dioxo-N-(3-pyridylmethyl)isoindoline-5-carboxamide CAS Name: 2-(3-methylbutyl)-1,3-dioxo-N-(3-pyridinylmethyl)-5-isoindolecarboxamide IUPAC Name: 2-(3-methylbutyl)-1,3-dioxo-N-(pyridin-3-ylmethyl)isoindole-5-carboxamide Traditional Name: 2-isoamyl-1,3-diketo-N-(3-pyridylmethyl)isoindoline-5-carboxamide Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

CC(C)CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C20H21N3O3/c1-13(2)7-9-23-19(25)16-6-5-15(10-17(16)20(23)26)18(24)22-12-14-4-3-8-21-11-14/h3-6,8,10-11,13H,7,9,12H2,1-2H3,(H,22,24)