9-[1-(phenylsulfonyl)indol-2-yl]-1,4-dioxa-8-azoniaspiro[4.5]decane

Systemtic Name: 9-[1-(phenylsulfonyl)indol-2-yl]-1,4-dioxa-8-azoniaspiro[4.5]decane Openeye Name: 9-[1-(benzenesulfonyl)indol-2-yl]-1,4-dioxa-8-azoniaspiro[4.5]decane CAS Name: 9-[1-(benzenesulfonyl)-2-indolyl]-1,4-dioxa-8-azoniaspiro[4.5]decane IUPAC Name: 9-[1-(benzenesulfonyl)indol-2-yl]-1,4-dioxa-8-azoniaspiro[4.5]decane Traditional Name: 9-(1-besylindol-2-yl)-1,4-dioxa-8-azoniaspiro[4.5]decane Formula: C21H23N2O4S+ MolecularWeight: 399.48332

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]C(CC12OCCO2)C3=CC4=CC=CC=C4N3S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1C[NH2+]C(CC12OCCO2)C3=CC4=CC=CC=C4N3S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C21H22N2O4S/c24-28(25,17-7-2-1-3-8-17)23-19-9-5-4-6-16(19)14-20(23)18-15-21(10-11-22-18)26-12-13-27-21/h1-9,14,18,22H,10-13,15H2/p+1