4-chloranyl-N-[2,6-di(propan-2-yl)phenyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[2,6-di(propan-2-yl)phenyl]-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-(2,6-diisopropylphenyl)-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-[2,6-di(propan-2-yl)phenyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-[2,6-di(propan-2-yl)phenyl]-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-(2,6-diisopropylphenyl)-3-nitro-benzenesulfonamide Formula: C18H21ClN2O4S MolecularWeight: 396.88834

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21ClN2O4S/c1-11(2)14-6-5-7-15(12(3)4)18(14)20-26(24,25)13-8-9-16(19)17(10-13)21(22)23/h5-12,20H,1-4H3