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

Systemtic Name: N-[3-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]dodecanamide Openeye Name: N-[3-(4-nitro-1,3-dioxo-isoindolin-2-yl)phenyl]dodecanamide CAS Name: N-[3-(4-nitro-1,3-dioxo-2-isoindolyl)phenyl]dodecanamide IUPAC Name: N-[3-(4-nitro-1,3-dioxoisoindol-2-yl)phenyl]dodecanamide Traditional Name: N-[3-(1,3-diketo-4-nitro-isoindolin-2-yl)phenyl]lauramide Formula: C26H31N3O5 MolecularWeight: 465.54144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC1=CC=CC(=C1)N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCC(=O)NC1=CC=CC(=C1)N2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C26H31N3O5/c1-2-3-4-5-6-7-8-9-10-17-23(30)27-19-13-11-14-20(18-19)28-25(31)21-15-12-16-22(29(33)34)24(21)26(28)32/h11-16,18H,2-10,17H2,1H3,(H,27,30)