2-[(2,4,6-trinitrophenyl)amino]butan-1-ol

Systemtic Name: 2-[(2,4,6-trinitrophenyl)amino]butan-1-ol Openeye Name: 2-(2,4,6-trinitroanilino)butan-1-ol CAS Name: 2-(2,4,6-trinitroanilino)-1-butanol IUPAC Name: 2-(2,4,6-trinitroanilino)butan-1-ol Traditional Name: 2-(2,4,6-trinitroanilino)butan-1-ol Formula: C10H12N4O7 MolecularWeight: 300.22488

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCC(CO)NC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C10H12N4O7/c1-2-6(5-15)11-10-8(13(18)19)3-7(12(16)17)4-9(10)14(20)21/h3-4,6,11,15H,2,5H2,1H3