2-butyl-1,1,3,3-tetraethyl-5-nitro-isoindole

Systemtic Name: 2-butyl-1,1,3,3-tetraethyl-5-nitro-isoindole Openeye Name: 2-butyl-1,1,3,3-tetraethyl-5-nitro-isoindoline CAS Name: 2-butyl-1,1,3,3-tetraethyl-5-nitroisoindole IUPAC Name: 2-butyl-1,1,3,3-tetraethyl-5-nitroisoindole Traditional Name: 2-butyl-1,1,3,3-tetraethyl-5-nitro-isoindoline Formula: C20H32N2O2 MolecularWeight: 332.48028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C2=C(C1(CC)CC)C=C(C=C2)[N+](=O)[O-])(CC)CC

Isomeric SMILES

CCCCN1C(C2=C(C1(CC)CC)C=C(C=C2)[N+](=O)[O-])(CC)CC

InChI

InChI=1S/C20H32N2O2/c1-6-11-14-21-19(7-2,8-3)17-13-12-16(22(23)24)15-18(17)20(21,9-4)10-5/h12-13,15H,6-11,14H2,1-5H3