4-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-3-nitro-benzaldehyde

Systemtic Name: 4-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-3-nitro-benzaldehyde Openeye Name: 4-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-3-nitro-benzaldehyde CAS Name: 4-[4-(2-chlorophenyl)sulfonyl-1-piperazinyl]-3-nitrobenzaldehyde IUPAC Name: 4-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-3-nitrobenzaldehyde Traditional Name: 4-[4-(2-chlorophenyl)sulfonylpiperazino]-3-nitro-benzaldehyde Formula: C17H16ClN3O5S MolecularWeight: 409.84404

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C=O)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3Cl

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C=O)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C17H16ClN3O5S/c18-14-3-1-2-4-17(14)27(25,26)20-9-7-19(8-10-20)15-6-5-13(12-22)11-16(15)21(23)24/h1-6,11-12H,7-10H2