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

Systemtic Name: N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-4-methylsulfonyl-2-nitro-aniline Openeye Name: N-[(1R)-1-(benzofuran-2-yl)ethyl]-4-methylsulfonyl-2-nitro-aniline CAS Name: N-[(1R)-1-(2-benzofuranyl)ethyl]-4-methylsulfonyl-2-nitroaniline IUPAC Name: N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-4-methylsulfonyl-2-nitroaniline Traditional Name: [(1R)-1-(benzofuran-2-yl)ethyl]-(4-mesyl-2-nitro-phenyl)amine Formula: C17H16N2O5S MolecularWeight: 360.38434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2O1)NC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1=CC2=CC=CC=C2O1)NC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O5S/c1-11(17-9-12-5-3-4-6-16(12)24-17)18-14-8-7-13(25(2,22)23)10-15(14)19(20)21/h3-11,18H,1-2H3/t11-/m1/s1