2-(3-chloranylphenoxy)ethyl 4-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: 2-(3-chloranylphenoxy)ethyl 4-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate Openeye Name: 2-(3-chlorophenoxy)ethyl 4-(4-acetylpiperazin-1-yl)sulfonylbenzoate CAS Name: 4-[(4-acetyl-1-piperazinyl)sulfonyl]benzoic acid 2-(3-chlorophenoxy)ethyl ester IUPAC Name: 2-(3-chlorophenoxy)ethyl 4-(4-acetylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 4-(4-acetylpiperazino)sulfonylbenzoic acid 2-(3-chlorophenoxy)ethyl ester Formula: C21H23ClN2O6S MolecularWeight: 466.93512

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCCOC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCCOC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H23ClN2O6S/c1-16(25)23-9-11-24(12-10-23)31(27,28)20-7-5-17(6-8-20)21(26)30-14-13-29-19-4-2-3-18(22)15-19/h2-8,15H,9-14H2,1H3