(2-chloranylquinolin-3-yl)methyl 4-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: (2-chloranylquinolin-3-yl)methyl 4-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate Openeye Name: (2-chloro-3-quinolyl)methyl 4-(4-acetylpiperazin-1-yl)sulfonylbenzoate CAS Name: 4-[(4-acetyl-1-piperazinyl)sulfonyl]benzoic acid (2-chloro-3-quinolinyl)methyl ester IUPAC Name: (2-chloroquinolin-3-yl)methyl 4-(4-acetylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 4-(4-acetylpiperazino)sulfonylbenzoic acid (2-chloro-3-quinolyl)methyl ester Formula: C23H22ClN3O5S MolecularWeight: 487.95588

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CC4=CC=CC=C4N=C3Cl

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CC4=CC=CC=C4N=C3Cl

InChI

InChI=1S/C23H22ClN3O5S/c1-16(28)26-10-12-27(13-11-26)33(30,31)20-8-6-17(7-9-20)23(29)32-15-19-14-18-4-2-3-5-21(18)25-22(19)24/h2-9,14H,10-13,15H2,1H3