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

Systemtic Name: 3-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(1-phenylethyl)propanamide Openeye Name: 3-(4-nitro-1,3-dioxo-isoindolin-2-yl)-N-(1-phenylethyl)propanamide CAS Name: 3-(4-nitro-1,3-dioxo-2-isoindolyl)-N-(1-phenylethyl)propanamide IUPAC Name: 3-(4-nitro-1,3-dioxoisoindol-2-yl)-N-(1-phenylethyl)propanamide Traditional Name: 3-(1,3-diketo-4-nitro-isoindolin-2-yl)-N-(1-phenylethyl)propionamide Formula: C19H17N3O5 MolecularWeight: 367.35538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17N3O5/c1-12(13-6-3-2-4-7-13)20-16(23)10-11-21-18(24)14-8-5-9-15(22(26)27)17(14)19(21)25/h2-9,12H,10-11H2,1H3,(H,20,23)