2-methyl-1-(methylamino)-2-nitro-1-phenylazanyl-butane-1,4-diol

Systemtic Name: 2-methyl-1-(methylamino)-2-nitro-1-phenylazanyl-butane-1,4-diol Openeye Name: 1-anilino-2-methyl-1-(methylamino)-2-nitro-butane-1,4-diol CAS Name: 1-anilino-2-methyl-1-(methylamino)-2-nitrobutane-1,4-diol IUPAC Name: 1-anilino-2-methyl-1-(methylamino)-2-nitrobutane-1,4-diol Traditional Name: 1-anilino-2-methyl-1-(methylamino)-2-nitro-butane-1,4-diol Formula: C12H19N3O4 MolecularWeight: 269.29696

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCO)(C(NC)(NC1=CC=CC=C1)O)[N+](=O)[O-]

Isomeric SMILES

CC(CCO)(C(NC)(NC1=CC=CC=C1)O)[N+](=O)[O-]

InChI

InChI=1S/C12H19N3O4/c1-11(8-9-16,15(18)19)12(17,13-2)14-10-6-4-3-5-7-10/h3-7,13-14,16-17H,8-9H2,1-2H3