(2-methyl-1,2-diphenyl-butyl) 4-nitrobenzoate

Systemtic Name: (2-methyl-1,2-diphenyl-butyl) 4-nitrobenzoate Openeye Name: (2-methyl-1,2-diphenyl-butyl) 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (2-methyl-1,2-diphenylbutyl) ester IUPAC Name: (2-methyl-1,2-diphenylbutyl) 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (2-methyl-1,2-diphenyl-butyl) ester Formula: C24H23NO4 MolecularWeight: 389.44372

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C1=CC=CC=C1)C(C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC(C)(C1=CC=CC=C1)C(C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H23NO4/c1-3-24(2,20-12-8-5-9-13-20)22(18-10-6-4-7-11-18)29-23(26)19-14-16-21(17-15-19)25(27)28/h4-17,22H,3H2,1-2H3