2-(2-methoxy-4-prop-2-enyl-phenoxy)-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone

Systemtic Name: 2-(2-methoxy-4-prop-2-enyl-phenoxy)-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Openeye Name: 2-(4-allyl-2-methoxy-phenoxy)-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone CAS Name: 2-(2-methoxy-4-prop-2-enylphenoxy)-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone IUPAC Name: 2-(2-methoxy-4-prop-2-enylphenoxy)-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Traditional Name: 2-(4-allyl-2-methoxy-phenoxy)-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Formula: C22H25NO3S MolecularWeight: 383.5038

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)COC3=C(C=C(C=C3)CC=C)OC

Isomeric SMILES

CC1CCN(C2=CC=CC=C2S1)C(=O)COC3=C(C=C(C=C3)CC=C)OC

InChI

InChI=1S/C22H25NO3S/c1-4-7-17-10-11-19(20(14-17)25-3)26-15-22(24)23-13-12-16(2)27-21-9-6-5-8-18(21)23/h4-6,8-11,14,16H,1,7,12-13,15H2,2-3H3