5-methoxy-2-[2-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]-2-oxidanylidene-ethoxy]benzaldehyde

Systemtic Name: 5-methoxy-2-[2-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]-2-oxidanylidene-ethoxy]benzaldehyde Openeye Name: 5-methoxy-2-[2-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]-2-oxo-ethoxy]benzaldehyde CAS Name: 5-methoxy-2-[2-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]-2-oxoethoxy]benzaldehyde IUPAC Name: 5-methoxy-2-[2-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]-2-oxoethoxy]benzaldehyde Traditional Name: 2-[2-keto-2-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]ethoxy]-5-methoxy-benzaldehyde Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H]1CCN(C2=CC=CC=C2S1)C(=O)COC3=C(C=C(C=C3)OC)C=O

InChI

InChI=1S/C20H21NO4S/c1-14-9-10-21(17-5-3-4-6-19(17)26-14)20(23)13-25-18-8-7-16(24-2)11-15(18)12-22/h3-8,11-12,14H,9-10,13H2,1-2H3/t14-/m0/s1