dibenzofuran-2-yl 2-chloranyl-5-(4-phenylpiperazin-1-yl)sulfonyl-benzoate

Systemtic Name: dibenzofuran-2-yl 2-chloranyl-5-(4-phenylpiperazin-1-yl)sulfonyl-benzoate Openeye Name: dibenzofuran-2-yl 2-chloro-5-(4-phenylpiperazin-1-yl)sulfonyl-benzoate CAS Name: 2-chloro-5-[(4-phenyl-1-piperazinyl)sulfonyl]benzoic acid 2-dibenzofuranyl ester IUPAC Name: dibenzofuran-2-yl 2-chloro-5-(4-phenylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 2-chloro-5-(4-phenylpiperazino)sulfonyl-benzoic acid dibenzofuran-2-yl ester Formula: C29H23ClN2O5S MolecularWeight: 547.02132

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)OC4=CC5=C(C=C4)OC6=CC=CC=C65

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)OC4=CC5=C(C=C4)OC6=CC=CC=C65

InChI

InChI=1S/C29H23ClN2O5S/c30-26-12-11-22(38(34,35)32-16-14-31(15-17-32)20-6-2-1-3-7-20)19-25(26)29(33)36-21-10-13-28-24(18-21)23-8-4-5-9-27(23)37-28/h1-13,18-19H,14-17H2