3-butyl-3-ethyl-8-methoxy-1,1-bis(oxidanylidene)-5-phenyl-4,5-dihydro-2H-1$l^{6}-benzothiepin-4-ol

Systemtic Name: 3-butyl-3-ethyl-8-methoxy-1,1-bis(oxidanylidene)-5-phenyl-4,5-dihydro-2H-1$l^{6}-benzothiepin-4-ol Openeye Name: 3-butyl-3-ethyl-8-methoxy-1,1-dioxo-5-phenyl-4,5-dihydro-2H-1$l^{6}-benzothiepin-4-ol CAS Name: 3-butyl-3-ethyl-8-methoxy-1,1-dioxo-5-phenyl-4,5-dihydro-2H-1$l^{6}-benzothiepin-4-ol IUPAC Name: 3-butyl-3-ethyl-8-methoxy-1,1-dioxo-5-phenyl-4,5-dihydro-2H-1$l^{6}-benzothiepin-4-ol Traditional Name: 3-butyl-3-ethyl-1,1-diketo-8-methoxy-5-phenyl-4,5-dihydro-2H-1$l^{6}-benzothiepin-4-ol Formula: C23H30O4S MolecularWeight: 402.5469

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CS(=O)(=O)C2=C(C=CC(=C2)OC)C(C1O)C3=CC=CC=C3)CC

Isomeric SMILES

CCCCC1(CS(=O)(=O)C2=C(C=CC(=C2)OC)C(C1O)C3=CC=CC=C3)CC

InChI

InChI=1S/C23H30O4S/c1-4-6-14-23(5-2)16-28(25,26)20-15-18(27-3)12-13-19(20)21(22(23)24)17-10-8-7-9-11-17/h7-13,15,21-22,24H,4-6,14,16H2,1-3H3