propyl 4-[[3-(4-ethanoylpiperazin-1-yl)sulfonylphenyl]carbonylamino]benzoate

Systemtic Name: propyl 4-[[3-(4-ethanoylpiperazin-1-yl)sulfonylphenyl]carbonylamino]benzoate Openeye Name: propyl 4-[[3-(4-acetylpiperazin-1-yl)sulfonylbenzoyl]amino]benzoate CAS Name: 4-[[[3-[(4-acetyl-1-piperazinyl)sulfonyl]phenyl]-oxomethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[3-(4-acetylpiperazin-1-yl)sulfonylbenzoyl]amino]benzoate Traditional Name: 4-[[3-(4-acetylpiperazino)sulfonylbenzoyl]amino]benzoic acid propyl ester Formula: C23H27N3O6S MolecularWeight: 473.54198

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C(=O)C

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C(=O)C

InChI

InChI=1S/C23H27N3O6S/c1-3-15-32-23(29)18-7-9-20(10-8-18)24-22(28)19-5-4-6-21(16-19)33(30,31)26-13-11-25(12-14-26)17(2)27/h4-10,16H,3,11-15H2,1-2H3,(H,24,28)