2-[(3-methoxyphenyl)methoxy]-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)propan-1-one

Systemtic Name: 2-[(3-methoxyphenyl)methoxy]-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)propan-1-one Openeye Name: 2-[(3-methoxyphenyl)methoxy]-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)propan-1-one CAS Name: 2-[(3-methoxyphenyl)methoxy]-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-1-propanone IUPAC Name: 2-[(3-methoxyphenyl)methoxy]-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)propan-1-one Traditional Name: 2-m-anisyloxy-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)propan-1-one Formula: C21H25NO3S MolecularWeight: 371.4931

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)C(C)OCC3=CC(=CC=C3)OC

Isomeric SMILES

CC1CCN(C2=CC=CC=C2S1)C(=O)C(C)OCC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H25NO3S/c1-15-11-12-22(19-9-4-5-10-20(19)26-15)21(23)16(2)25-14-17-7-6-8-18(13-17)24-3/h4-10,13,15-16H,11-12,14H2,1-3H3