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

Systemtic Name: 3-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-propan-2-yloxyphenyl)propanamide Openeye Name: N-(4-isopropoxyphenyl)-3-(4-nitro-1,3-dioxo-isoindolin-2-yl)propanamide CAS Name: 3-(4-nitro-1,3-dioxo-2-isoindolyl)-N-(4-propan-2-yloxyphenyl)propanamide IUPAC Name: 3-(4-nitro-1,3-dioxoisoindol-2-yl)-N-(4-propan-2-yloxyphenyl)propanamide Traditional Name: 3-(1,3-diketo-4-nitro-isoindolin-2-yl)-N-(4-isopropoxyphenyl)propionamide Formula: C20H19N3O6 MolecularWeight: 397.38136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)NC(=O)CCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)NC(=O)CCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O6/c1-12(2)29-14-8-6-13(7-9-14)21-17(24)10-11-22-19(25)15-4-3-5-16(23(27)28)18(15)20(22)26/h3-9,12H,10-11H2,1-2H3,(H,21,24)