N-[(S)-cyclopropyl(phenyl)methyl]-2,3-dimethyl-5-nitro-benzenesulfonamide

Systemtic Name: N-[(S)-cyclopropyl(phenyl)methyl]-2,3-dimethyl-5-nitro-benzenesulfonamide Openeye Name: N-[(S)-cyclopropyl(phenyl)methyl]-2,3-dimethyl-5-nitro-benzenesulfonamide CAS Name: N-[(S)-cyclopropyl(phenyl)methyl]-2,3-dimethyl-5-nitrobenzenesulfonamide IUPAC Name: N-[(S)-cyclopropyl(phenyl)methyl]-2,3-dimethyl-5-nitrobenzenesulfonamide Traditional Name: N-[(S)-cyclopropyl(phenyl)methyl]-2,3-dimethyl-5-nitro-benzenesulfonamide Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)NC(C2CC2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)N[C@@H](C2CC2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O4S/c1-12-10-16(20(21)22)11-17(13(12)2)25(23,24)19-18(15-8-9-15)14-6-4-3-5-7-14/h3-7,10-11,15,18-19H,8-9H2,1-2H3/t18-/m1/s1