5-(1-methoxyethyl)-10,10-bis(oxidanylidene)pyrrolo[1,2-b][1,2,5]benzothiadiazepin-4-one

Systemtic Name: 5-(1-methoxyethyl)-10,10-bis(oxidanylidene)pyrrolo[1,2-b][1,2,5]benzothiadiazepin-4-one Openeye Name: 5-(1-methoxyethyl)-10,10-dioxo-pyrrolo[1,2-b][1,2,5]benzothiadiazepin-4-one CAS Name: 5-(1-methoxyethyl)-10,10-dioxo-4-pyrrolo[1,2-b][1,2,5]benzothiadiazepinone IUPAC Name: 5-(1-methoxyethyl)-10,10-dioxopyrrolo[1,2-b][1,2,5]benzothiadiazepin-4-one Traditional Name: 10,10-diketo-5-(1-methoxyethyl)pyrrolo[1,2-b][1,2,5]benzothiadiazepin-4-one Formula: C14H14N2O4S MolecularWeight: 306.33696

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Descriptors Computed from Structure

Canonical SMILES:

CC(N1C2=CC=CC=C2S(=O)(=O)N3C=CC=C3C1=O)OC

Isomeric SMILES

CC(N1C2=CC=CC=C2S(=O)(=O)N3C=CC=C3C1=O)OC

InChI

InChI=1S/C14H14N2O4S/c1-10(20-2)16-11-6-3-4-8-13(11)21(18,19)15-9-5-7-12(15)14(16)17/h3-10H,1-2H3