3,3-dimethylbutyl 4-(4-nitrophenyl)butanoate

Systemtic Name: 3,3-dimethylbutyl 4-(4-nitrophenyl)butanoate Openeye Name: 3,3-dimethylbutyl 4-(4-nitrophenyl)butanoate CAS Name: 4-(4-nitrophenyl)butanoic acid 3,3-dimethylbutyl ester IUPAC Name: 3,3-dimethylbutyl 4-(4-nitrophenyl)butanoate Traditional Name: 4-(4-nitrophenyl)butyric acid 3,3-dimethylbutyl ester Formula: C16H23NO4 MolecularWeight: 293.35812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCOC(=O)CCCC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)CCOC(=O)CCCC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C16H23NO4/c1-16(2,3)11-12-21-15(18)6-4-5-13-7-9-14(10-8-13)17(19)20/h7-10H,4-6,11-12H2,1-3H3