methyl 1-[2-[4-(4-ethanoylpiperazin-1-yl)sulfonylphenyl]carbonyloxyethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[4-(4-ethanoylpiperazin-1-yl)sulfonylphenyl]carbonyloxyethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-[4-(4-acetylpiperazin-1-yl)sulfonylbenzoyl]oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[[4-[(4-acetyl-1-piperazinyl)sulfonyl]phenyl]-oxomethoxy]-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[4-(4-acetylpiperazin-1-yl)sulfonylbenzoyl]oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[4-(4-acetylpiperazino)sulfonylbenzoyl]oxyacetyl]isonipecotic acid methyl ester Formula: C22H29N3O8S MolecularWeight: 495.54596

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC(=O)N3CCC(CC3)C(=O)OC

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC(=O)N3CCC(CC3)C(=O)OC

InChI

InChI=1S/C22H29N3O8S/c1-16(26)23-11-13-25(14-12-23)34(30,31)19-5-3-17(4-6-19)22(29)33-15-20(27)24-9-7-18(8-10-24)21(28)32-2/h3-6,18H,7-15H2,1-2H3