2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(3-propan-2-yloxypropyl)ethanamide

Systemtic Name: 2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(3-propan-2-yloxypropyl)ethanamide Openeye Name: N-(3-isopropoxypropyl)-2-(4-nitro-1,3-dioxo-isoindolin-2-yl)acetamide CAS Name: 2-(4-nitro-1,3-dioxo-2-isoindolyl)-N-(3-propan-2-yloxypropyl)acetamide IUPAC Name: 2-(4-nitro-1,3-dioxoisoindol-2-yl)-N-(3-propan-2-yloxypropyl)acetamide Traditional Name: 2-(1,3-diketo-4-nitro-isoindolin-2-yl)-N-(3-isopropoxypropyl)acetamide Formula: C16H19N3O6 MolecularWeight: 349.33856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)CN1C(=O)C2=C(C1=O)C(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)OCCCNC(=O)CN1C(=O)C2=C(C1=O)C(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H19N3O6/c1-10(2)25-8-4-7-17-13(20)9-18-15(21)11-5-3-6-12(19(23)24)14(11)16(18)22/h3,5-6,10H,4,7-9H2,1-2H3,(H,17,20)