(2R)-2-[(3-methyl-4-nitro-phenyl)amino]hexan-1-ol

Systemtic Name: (2R)-2-[(3-methyl-4-nitro-phenyl)amino]hexan-1-ol Openeye Name: (2R)-2-(3-methyl-4-nitro-anilino)hexan-1-ol CAS Name: (2R)-2-(3-methyl-4-nitroanilino)-1-hexanol IUPAC Name: (2R)-2-(3-methyl-4-nitroanilino)hexan-1-ol Traditional Name: (2R)-2-(3-methyl-4-nitro-anilino)hexan-1-ol Formula: C13H20N2O3 MolecularWeight: 252.3095

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCC[C@H](CO)NC1=CC(=C(C=C1)[N+](=O)[O-])C

InChI

InChI=1S/C13H20N2O3/c1-3-4-5-12(9-16)14-11-6-7-13(15(17)18)10(2)8-11/h6-8,12,14,16H,3-5,9H2,1-2H3/t12-/m1/s1