N-[(1R)-1-(4-bromophenyl)ethyl]-4-methylsulfonyl-2-nitro-aniline

Systemtic Name: N-[(1R)-1-(4-bromophenyl)ethyl]-4-methylsulfonyl-2-nitro-aniline Openeye Name: N-[(1R)-1-(4-bromophenyl)ethyl]-4-methylsulfonyl-2-nitro-aniline CAS Name: N-[(1R)-1-(4-bromophenyl)ethyl]-4-methylsulfonyl-2-nitroaniline IUPAC Name: N-[(1R)-1-(4-bromophenyl)ethyl]-4-methylsulfonyl-2-nitroaniline Traditional Name: [(1R)-1-(4-bromophenyl)ethyl]-(4-mesyl-2-nitro-phenyl)amine Formula: C15H15BrN2O4S MolecularWeight: 399.2596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)Br)NC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1=CC=C(C=C1)Br)NC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C15H15BrN2O4S/c1-10(11-3-5-12(16)6-4-11)17-14-8-7-13(23(2,21)22)9-15(14)18(19)20/h3-10,17H,1-2H3/t10-/m1/s1