3,3-dibutyl-7-methoxy-1,1-bis(oxidanylidene)-5-phenyl-2,4-dihydro-1$l^{6},5-benzothiazepin-8-ol

Systemtic Name: 3,3-dibutyl-7-methoxy-1,1-bis(oxidanylidene)-5-phenyl-2,4-dihydro-1$l^{6},5-benzothiazepin-8-ol Openeye Name: 3,3-dibutyl-7-methoxy-1,1-dioxo-5-phenyl-2,4-dihydro-1$l^{6},5-benzothiazepin-8-ol CAS Name: 3,3-dibutyl-7-methoxy-1,1-dioxo-5-phenyl-2,4-dihydro-1$l^{6},5-benzothiazepin-8-ol IUPAC Name: 3,3-dibutyl-7-methoxy-1,1-dioxo-5-phenyl-2,4-dihydro-1$l^{6},5-benzothiazepin-8-ol Traditional Name: 3,3-dibutyl-1,1-diketo-7-methoxy-5-phenyl-2,4-dihydro-1$l^{6},5-benzothiazepin-8-ol Formula: C24H33NO4S MolecularWeight: 431.58812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CN(C2=CC(=C(C=C2S(=O)(=O)C1)O)OC)C3=CC=CC=C3)CCCC

Isomeric SMILES

CCCCC1(CN(C2=CC(=C(C=C2S(=O)(=O)C1)O)OC)C3=CC=CC=C3)CCCC

InChI

InChI=1S/C24H33NO4S/c1-4-6-13-24(14-7-5-2)17-25(19-11-9-8-10-12-19)20-15-22(29-3)21(26)16-23(20)30(27,28)18-24/h8-12,15-16,26H,4-7,13-14,17-18H2,1-3H3