1-azanyl-2-nitro-1-phenylazanyl-2-propyl-butane-1,4-diol

Systemtic Name: 1-azanyl-2-nitro-1-phenylazanyl-2-propyl-butane-1,4-diol Openeye Name: 1-amino-1-anilino-2-nitro-2-propyl-butane-1,4-diol CAS Name: 1-amino-1-anilino-2-nitro-2-propylbutane-1,4-diol IUPAC Name: 1-amino-1-anilino-2-nitro-2-propylbutane-1,4-diol Traditional Name: 1-amino-1-anilino-2-nitro-2-propyl-butane-1,4-diol Formula: C13H21N3O4 MolecularWeight: 283.32354

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21N3O4/c1-2-8-12(9-10-17,16(19)20)13(14,18)15-11-6-4-3-5-7-11/h3-7,15,17-18H,2,8-10,14H2,1H3