3-nitro-4-[[(1R)-1-phenylethyl]amino]-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 3-nitro-4-[[(1R)-1-phenylethyl]amino]-N-propan-2-yl-benzenesulfonamide Openeye Name: N-isopropyl-3-nitro-4-[[(1R)-1-phenylethyl]amino]benzenesulfonamide CAS Name: 3-nitro-4-[[(1R)-1-phenylethyl]amino]-N-propan-2-ylbenzenesulfonamide IUPAC Name: 3-nitro-4-[[(1R)-1-phenylethyl]amino]-N-propan-2-ylbenzenesulfonamide Traditional Name: N-isopropyl-3-nitro-4-[[(1R)-1-phenylethyl]amino]benzenesulfonamide Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O4S/c1-12(2)19-25(23,24)15-9-10-16(17(11-15)20(21)22)18-13(3)14-7-5-4-6-8-14/h4-13,18-19H,1-3H3/t13-/m1/s1