2-[4-(4-chlorophenyl)piperazin-1-yl]-6,8-dinitro-1,3-benzothiazin-4-one

Systemtic Name: 2-[4-(4-chlorophenyl)piperazin-1-yl]-6,8-dinitro-1,3-benzothiazin-4-one Openeye Name: 2-[4-(4-chlorophenyl)piperazin-1-yl]-6,8-dinitro-1,3-benzothiazin-4-one CAS Name: 2-[4-(4-chlorophenyl)-1-piperazinyl]-6,8-dinitro-1,3-benzothiazin-4-one IUPAC Name: 2-[4-(4-chlorophenyl)piperazin-1-yl]-6,8-dinitro-1,3-benzothiazin-4-one Traditional Name: 2-[4-(4-chlorophenyl)piperazino]-6,8-dinitro-1,3-benzothiazin-4-one Formula: C18H14ClN5O5S MolecularWeight: 447.85226

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)Cl)C3=NC(=O)C4=CC(=CC(=C4S3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)Cl)C3=NC(=O)C4=CC(=CC(=C4S3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H14ClN5O5S/c19-11-1-3-12(4-2-11)21-5-7-22(8-6-21)18-20-17(25)14-9-13(23(26)27)10-15(24(28)29)16(14)30-18/h1-4,9-10H,5-8H2