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

Systemtic Name: N-cyclododecyl-3-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]propanamide Openeye Name: N-cyclododecyl-3-(4-nitro-1,3-dioxo-isoindolin-2-yl)propanamide CAS Name: N-cyclododecyl-3-(4-nitro-1,3-dioxo-2-isoindolyl)propanamide IUPAC Name: N-cyclododecyl-3-(4-nitro-1,3-dioxoisoindol-2-yl)propanamide Traditional Name: N-cyclododecyl-3-(1,3-diketo-4-nitro-isoindolin-2-yl)propionamide Formula: C23H31N3O5 MolecularWeight: 429.50934

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCC(CCCCC1)NC(=O)CCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCCCCC(CCCCC1)NC(=O)CCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H31N3O5/c27-20(24-17-11-8-6-4-2-1-3-5-7-9-12-17)15-16-25-22(28)18-13-10-14-19(26(30)31)21(18)23(25)29/h10,13-14,17H,1-9,11-12,15-16H2,(H,24,27)