N-(1-adamantylmethyl)-2-chloranyl-5-nitro-benzenesulfonamide

Systemtic Name: N-(1-adamantylmethyl)-2-chloranyl-5-nitro-benzenesulfonamide Openeye Name: N-(1-adamantylmethyl)-2-chloro-5-nitro-benzenesulfonamide CAS Name: N-(1-adamantylmethyl)-2-chloro-5-nitrobenzenesulfonamide IUPAC Name: N-(1-adamantylmethyl)-2-chloro-5-nitrobenzenesulfonamide Traditional Name: N-(1-adamantylmethyl)-2-chloro-5-nitro-benzenesulfonamide Formula: C17H21ClN2O4S MolecularWeight: 384.87764

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNS(=O)(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNS(=O)(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H21ClN2O4S/c18-15-2-1-14(20(21)22)6-16(15)25(23,24)19-10-17-7-11-3-12(8-17)5-13(4-11)9-17/h1-2,6,11-13,19H,3-5,7-10H2