(2-methyl-4-phenyl-pentyl) 4-nitrobenzoate

Systemtic Name: (2-methyl-4-phenyl-pentyl) 4-nitrobenzoate Openeye Name: (2-methyl-4-phenyl-pentyl) 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (2-methyl-4-phenylpentyl) ester IUPAC Name: (2-methyl-4-phenylpentyl) 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (2-methyl-4-phenyl-pentyl) ester Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21NO4/c1-14(12-15(2)16-6-4-3-5-7-16)13-24-19(21)17-8-10-18(11-9-17)20(22)23/h3-11,14-15H,12-13H2,1-2H3