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

Systemtic Name: 1,3-bis(oxidanylidene)-2-(3-propan-2-yloxypropyl)-N-(pyridin-3-ylmethyl)isoindole-5-carboxamide Openeye Name: 2-(3-isopropoxypropyl)-1,3-dioxo-N-(3-pyridylmethyl)isoindoline-5-carboxamide CAS Name: 1,3-dioxo-2-(3-propan-2-yloxypropyl)-N-(3-pyridinylmethyl)-5-isoindolecarboxamide IUPAC Name: 1,3-dioxo-2-(3-propan-2-yloxypropyl)-N-(pyridin-3-ylmethyl)isoindole-5-carboxamide Traditional Name: 2-(3-isopropoxypropyl)-1,3-diketo-N-(3-pyridylmethyl)isoindoline-5-carboxamide Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

CC(C)OCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C21H23N3O4/c1-14(2)28-10-4-9-24-20(26)17-7-6-16(11-18(17)21(24)27)19(25)23-13-15-5-3-8-22-12-15/h3,5-8,11-12,14H,4,9-10,13H2,1-2H3,(H,23,25)