(3-nitrophenyl)methyl 4-tert-butylbenzoate

Systemtic Name: (3-nitrophenyl)methyl 4-tert-butylbenzoate Openeye Name: (3-nitrophenyl)methyl 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid (3-nitrobenzyl) ester Formula: C18H19NO4 MolecularWeight: 313.34776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)OCC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)OCC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H19NO4/c1-18(2,3)15-9-7-14(8-10-15)17(20)23-12-13-5-4-6-16(11-13)19(21)22/h4-11H,12H2,1-3H3