1-(phenylmethyl)-5-piperazin-1-yl-4,2$l^{6},1-benzoxathiazine 2,2-dioxide

Systemtic Name: 1-(phenylmethyl)-5-piperazin-1-yl-4,2$l^{6},1-benzoxathiazine 2,2-dioxide Openeye Name: 1-benzyl-5-piperazin-1-yl-4,2$l^{6},1-benzoxathiazine 2,2-dioxide CAS Name: 1-(phenylmethyl)-5-(1-piperazinyl)-4,2$l^{6},1-benzoxathiazine 2,2-dioxide IUPAC Name: 1-benzyl-5-piperazin-1-yl-4,2$l^{6},1-benzoxathiazine 2,2-dioxide Traditional Name: 1-benzyl-5-piperazino-4,2$l^{6},1-benzoxathiazine 2,2-dioxide Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C3C(=CC=C2)N(S(=O)(=O)CO3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1)C2=C3C(=CC=C2)N(S(=O)(=O)CO3)CC4=CC=CC=C4

InChI

InChI=1S/C18H21N3O3S/c22-25(23)14-24-18-16(20-11-9-19-10-12-20)7-4-8-17(18)21(25)13-15-5-2-1-3-6-15/h1-8,19H,9-14H2