4-(3,5-dimethoxyphenyl)-1,1-diethoxy-3-nitro-butan-2-ol

Systemtic Name: 4-(3,5-dimethoxyphenyl)-1,1-diethoxy-3-nitro-butan-2-ol Openeye Name: 4-(3,5-dimethoxyphenyl)-1,1-diethoxy-3-nitro-butan-2-ol CAS Name: 4-(3,5-dimethoxyphenyl)-1,1-diethoxy-3-nitro-2-butanol IUPAC Name: 4-(3,5-dimethoxyphenyl)-1,1-diethoxy-3-nitrobutan-2-ol Traditional Name: 4-(3,5-dimethoxyphenyl)-1,1-diethoxy-3-nitro-butan-2-ol Formula: C16H25NO7 MolecularWeight: 343.3722

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C(C(CC1=CC(=CC(=C1)OC)OC)[N+](=O)[O-])O)OCC

Isomeric SMILES

CCOC(C(C(CC1=CC(=CC(=C1)OC)OC)[N+](=O)[O-])O)OCC

InChI

InChI=1S/C16H25NO7/c1-5-23-16(24-6-2)15(18)14(17(19)20)9-11-7-12(21-3)10-13(8-11)22-4/h7-8,10,14-16,18H,5-6,9H2,1-4H3