1,2-bis(chloranyl)benzene; 4-phenylpiperazine-1-sulfonic acid

Systemtic Name: 1,2-bis(chloranyl)benzene; 4-phenylpiperazine-1-sulfonic acid Openeye Name: 1,2-dichlorobenzene; 4-phenylpiperazine-1-sulfonic acid CAS Name: 1,2-dichlorobenzene; 4-phenyl-1-piperazinesulfonic acid IUPAC Name: 1,2-dichlorobenzene; 4-phenylpiperazine-1-sulfonic acid Traditional Name: 1,2-dichlorobenzene; 4-phenylpiperazine-1-sulfonic acid Formula: C16H18Cl2N2O3S MolecularWeight: 389.29672

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)O.C1=CC=C(C(=C1)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)O.C1=CC=C(C(=C1)Cl)Cl

InChI

InChI=1S/C10H14N2O3S.C6H4Cl2/c13-16(14,15)12-8-6-11(7-9-12)10-4-2-1-3-5-10;7-5-3-1-2-4-6(5)8/h1-5H,6-9H2,(H,13,14,15);1-4H