2-butyl-4-(phenylmethoxymethyl)-9-pyrrolidin-1-yl-3,4-dihydro-5,1$l^{6},2-benzoxathiazepine 1,1-dioxide

Systemtic Name: 2-butyl-4-(phenylmethoxymethyl)-9-pyrrolidin-1-yl-3,4-dihydro-5,1$l^{6},2-benzoxathiazepine 1,1-dioxide Openeye Name: 4-(benzyloxymethyl)-2-butyl-9-pyrrolidin-1-yl-3,4-dihydro-5,1$l^{6},2-benzoxathiazepine 1,1-dioxide CAS Name: 2-butyl-4-(phenylmethoxymethyl)-9-(1-pyrrolidinyl)-3,4-dihydro-5,1$l^{6},2-benzoxathiazepine 1,1-dioxide IUPAC Name: 2-butyl-4-(phenylmethoxymethyl)-9-pyrrolidin-1-yl-3,4-dihydro-5,1$l^{6},2-benzoxathiazepine 1,1-dioxide Traditional Name: 4-(benzoxymethyl)-2-butyl-9-pyrrolidino-3,4-dihydro-5,1$l^{6},2-benzoxathiazepine 1,1-dioxide Formula: C24H32N2O4S MolecularWeight: 444.58688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC(OC2=CC=CC(=C2S1(=O)=O)N3CCCC3)COCC4=CC=CC=C4

Isomeric SMILES

CCCCN1CC(OC2=CC=CC(=C2S1(=O)=O)N3CCCC3)COCC4=CC=CC=C4

InChI

InChI=1S/C24H32N2O4S/c1-2-3-16-26-17-21(19-29-18-20-10-5-4-6-11-20)30-23-13-9-12-22(24(23)31(26,27)28)25-14-7-8-15-25/h4-6,9-13,21H,2-3,7-8,14-19H2,1H3