6-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(1-phenylethyl)hexanamide

Systemtic Name: 6-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(1-phenylethyl)hexanamide Openeye Name: 6-(4-nitro-1,3-dioxo-isoindolin-2-yl)-N-(1-phenylethyl)hexanamide CAS Name: 6-(4-nitro-1,3-dioxo-2-isoindolyl)-N-(1-phenylethyl)hexanamide IUPAC Name: 6-(4-nitro-1,3-dioxoisoindol-2-yl)-N-(1-phenylethyl)hexanamide Traditional Name: 6-(1,3-diketo-4-nitro-isoindolin-2-yl)-N-(1-phenylethyl)hexanamide Formula: C22H23N3O5 MolecularWeight: 409.43512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)CCCCCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)CCCCCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H23N3O5/c1-15(16-9-4-2-5-10-16)23-19(26)13-6-3-7-14-24-21(27)17-11-8-12-18(25(29)30)20(17)22(24)28/h2,4-5,8-12,15H,3,6-7,13-14H2,1H3,(H,23,26)