(1-methoxy-2-methyl-1-phenyl-propan-2-yl) 4-nitrobenzoate

Systemtic Name: (1-methoxy-2-methyl-1-phenyl-propan-2-yl) 4-nitrobenzoate Openeye Name: (2-methoxy-1,1-dimethyl-2-phenyl-ethyl) 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (1-methoxy-2-methyl-1-phenylpropan-2-yl) ester IUPAC Name: (1-methoxy-2-methyl-1-phenylpropan-2-yl) 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (2-methoxy-1,1-dimethyl-2-phenyl-ethyl) ester Formula: C18H19NO5 MolecularWeight: 329.34716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C1=CC=CC=C1)OC)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C(C1=CC=CC=C1)OC)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H19NO5/c1-18(2,16(23-3)13-7-5-4-6-8-13)24-17(20)14-9-11-15(12-10-14)19(21)22/h4-12,16H,1-3H3