1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-(3-nitrophenoxy)ethanone

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-(3-nitrophenoxy)ethanone Openeye Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-(3-nitrophenoxy)ethanone CAS Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-(3-nitrophenoxy)ethanone IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-(3-nitrophenoxy)ethanone Traditional Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-(3-nitrophenoxy)ethanone Formula: C17H16N2O4S MolecularWeight: 344.38494

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)C(=O)COC3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)C(=O)COC3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O4S/c20-17(12-23-14-6-3-5-13(11-14)19(21)22)18-9-4-10-24-16-8-2-1-7-15(16)18/h1-3,5-8,11H,4,9-10,12H2