1,1-diethoxy-4-(4-hexylphenyl)-3-nitro-butan-2-ol

Systemtic Name: 1,1-diethoxy-4-(4-hexylphenyl)-3-nitro-butan-2-ol Openeye Name: 1,1-diethoxy-4-(4-hexylphenyl)-3-nitro-butan-2-ol CAS Name: 1,1-diethoxy-4-(4-hexylphenyl)-3-nitro-2-butanol IUPAC Name: 1,1-diethoxy-4-(4-hexylphenyl)-3-nitrobutan-2-ol Traditional Name: 1,1-diethoxy-4-(4-hexylphenyl)-3-nitro-butan-2-ol Formula: C20H33NO5 MolecularWeight: 367.47972

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)CC(C(C(OCC)OCC)O)[N+](=O)[O-]

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)CC(C(C(OCC)OCC)O)[N+](=O)[O-]

InChI

InChI=1S/C20H33NO5/c1-4-7-8-9-10-16-11-13-17(14-12-16)15-18(21(23)24)19(22)20(25-5-2)26-6-3/h11-14,18-20,22H,4-10,15H2,1-3H3