3-[(4-methyl-2,6-dinitro-phenyl)amino]propan-1-ol

Systemtic Name: 3-[(4-methyl-2,6-dinitro-phenyl)amino]propan-1-ol Openeye Name: 3-(4-methyl-2,6-dinitro-anilino)propan-1-ol CAS Name: 3-(4-methyl-2,6-dinitroanilino)-1-propanol IUPAC Name: 3-(4-methyl-2,6-dinitroanilino)propan-1-ol Traditional Name: 3-(4-methyl-2,6-dinitro-anilino)propan-1-ol Formula: C10H13N3O5 MolecularWeight: 255.22732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)[N+](=O)[O-])NCCCO)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1)[N+](=O)[O-])NCCCO)[N+](=O)[O-]

InChI

InChI=1S/C10H13N3O5/c1-7-5-8(12(15)16)10(11-3-2-4-14)9(6-7)13(17)18/h5-6,11,14H,2-4H2,1H3