2-[2-[4-(2-nitrophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4H-1,4-benzothiazin-3-one

Systemtic Name: 2-[2-[4-(2-nitrophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4H-1,4-benzothiazin-3-one Openeye Name: 2-[2-[4-(2-nitrophenyl)piperazin-1-yl]-2-oxo-ethyl]-4H-1,4-benzothiazin-3-one CAS Name: 2-[2-[4-(2-nitrophenyl)-1-piperazinyl]-2-oxoethyl]-4H-1,4-benzothiazin-3-one IUPAC Name: 2-[2-[4-(2-nitrophenyl)piperazin-1-yl]-2-oxoethyl]-4H-1,4-benzothiazin-3-one Traditional Name: 2-[2-keto-2-[4-(2-nitrophenyl)piperazino]ethyl]-4H-1,4-benzothiazin-3-one Formula: C20H20N4O4S MolecularWeight: 412.4622

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])C(=O)CC3C(=O)NC4=CC=CC=C4S3

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2[N+](=O)[O-])C(=O)CC3C(=O)NC4=CC=CC=C4S3

InChI

InChI=1S/C20H20N4O4S/c25-19(13-18-20(26)21-14-5-1-4-8-17(14)29-18)23-11-9-22(10-12-23)15-6-2-3-7-16(15)24(27)28/h1-8,18H,9-13H2,(H,21,26)