N-(1-adamantylmethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-(1-adamantylmethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-(1-adamantylmethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-(1-adamantylmethyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-(1-adamantylmethyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-(1-adamantylmethyl)-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C20H27NO4S MolecularWeight: 377.49768

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)NCC34CC5CC(C3)CC(C5)C4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)NCC34CC5CC(C3)CC(C5)C4)OC1

InChI

InChI=1S/C20H27NO4S/c22-26(23,17-2-3-18-19(9-17)25-5-1-4-24-18)21-13-20-10-14-6-15(11-20)8-16(7-14)12-20/h2-3,9,14-16,21H,1,4-8,10-13H2