1-dodecyl-2-methyl-3-nitro-pyrrole

Systemtic Name: 1-dodecyl-2-methyl-3-nitro-pyrrole Openeye Name: 1-dodecyl-2-methyl-3-nitro-pyrrole CAS Name: 1-dodecyl-2-methyl-3-nitropyrrole IUPAC Name: 1-dodecyl-2-methyl-3-nitropyrrole Traditional Name: 1-lauryl-2-methyl-3-nitro-pyrrole Formula: C17H30N2O2 MolecularWeight: 294.4323

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1C=CC(=C1C)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCN1C=CC(=C1C)[N+](=O)[O-]

InChI

InChI=1S/C17H30N2O2/c1-3-4-5-6-7-8-9-10-11-12-14-18-15-13-17(16(18)2)19(20)21/h13,15H,3-12,14H2,1-2H3