(3-cyclopropyl-2,4-dimethyl-pentan-3-yl) 4-nitrobenzoate

Systemtic Name: (3-cyclopropyl-2,4-dimethyl-pentan-3-yl) 4-nitrobenzoate Openeye Name: (1-cyclopropyl-1-isopropyl-2-methyl-propyl) 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (3-cyclopropyl-2,4-dimethylpentan-3-yl) ester IUPAC Name: (3-cyclopropyl-2,4-dimethylpentan-3-yl) 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (1-cyclopropyl-1-isopropyl-2-methyl-propyl) ester Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1CC1)(C(C)C)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(C1CC1)(C(C)C)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H23NO4/c1-11(2)17(12(3)4,14-7-8-14)22-16(19)13-5-9-15(10-6-13)18(20)21/h5-6,9-12,14H,7-8H2,1-4H3