N-(2-adamantyl)-4-isocyanato-benzenesulfonamide

Systemtic Name: N-(2-adamantyl)-4-isocyanato-benzenesulfonamide Openeye Name: N-(2-adamantyl)-4-isocyanato-benzenesulfonamide CAS Name: N-(2-adamantyl)-4-isocyanatobenzenesulfonamide IUPAC Name: N-(2-adamantyl)-4-isocyanatobenzenesulfonamide Traditional Name: N-(2-adamantyl)-4-isocyanato-benzenesulfonamide Formula: C17H20N2O3S MolecularWeight: 332.4173

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NS(=O)(=O)C4=CC=C(C=C4)N=C=O

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NS(=O)(=O)C4=CC=C(C=C4)N=C=O

InChI

InChI=1S/C17H20N2O3S/c20-10-18-15-1-3-16(4-2-15)23(21,22)19-17-13-6-11-5-12(8-13)9-14(17)7-11/h1-4,11-14,17,19H,5-9H2