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

Systemtic Name: 2-[2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxidanylidene-ethoxy]benzaldehyde Openeye Name: 2-[2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxo-ethoxy]benzaldehyde CAS Name: 2-[2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxoethoxy]benzaldehyde IUPAC Name: 2-[2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxoethoxy]benzaldehyde Traditional Name: 2-[2-keto-2-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethoxy]benzaldehyde Formula: C19H19NO3S MolecularWeight: 341.42406

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)COC3=CC=CC=C3C=O

Isomeric SMILES

CC1CCN(C2=CC=CC=C2S1)C(=O)COC3=CC=CC=C3C=O

InChI

InChI=1S/C19H19NO3S/c1-14-10-11-20(16-7-3-5-9-18(16)24-14)19(22)13-23-17-8-4-2-6-15(17)12-21/h2-9,12,14H,10-11,13H2,1H3