(4-nitrophenyl)methyl 2-(4-bromophenyl)sulfanylethanoate

Systemtic Name: (4-nitrophenyl)methyl 2-(4-bromophenyl)sulfanylethanoate Openeye Name: (4-nitrophenyl)methyl 2-(4-bromophenyl)sulfanylacetate CAS Name: 2-[(4-bromophenyl)thio]acetic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-(4-bromophenyl)sulfanylacetate Traditional Name: 2-[(4-bromophenyl)thio]acetic acid (4-nitrobenzyl) ester Formula: C15H12BrNO4S MolecularWeight: 382.22908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1COC(=O)CSC2=CC=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1COC(=O)CSC2=CC=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C15H12BrNO4S/c16-12-3-7-14(8-4-12)22-10-15(18)21-9-11-1-5-13(6-2-11)17(19)20/h1-8H,9-10H2