2-(2-methylphenoxy)ethyl 4-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: 2-(2-methylphenoxy)ethyl 4-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate Openeye Name: 2-(2-methylphenoxy)ethyl 4-(4-acetylpiperazin-1-yl)sulfonylbenzoate CAS Name: 4-[(4-acetyl-1-piperazinyl)sulfonyl]benzoic acid 2-(2-methylphenoxy)ethyl ester IUPAC Name: 2-(2-methylphenoxy)ethyl 4-(4-acetylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 4-(4-acetylpiperazino)sulfonylbenzoic acid 2-(2-methylphenoxy)ethyl ester Formula: C22H26N2O6S MolecularWeight: 446.51664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCOC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)C

Isomeric SMILES

CC1=CC=CC=C1OCCOC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)C

InChI

InChI=1S/C22H26N2O6S/c1-17-5-3-4-6-21(17)29-15-16-30-22(26)19-7-9-20(10-8-19)31(27,28)24-13-11-23(12-14-24)18(2)25/h3-10H,11-16H2,1-2H3