methyl 2-[1-[(4-ethanoylphenyl)carbamoyl]piperidin-4-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[1-[(4-ethanoylphenyl)carbamoyl]piperidin-4-yl]sulfonylbenzoate Openeye Name: methyl 2-[[1-[(4-acetylphenyl)carbamoyl]-4-piperidyl]sulfonyl]benzoate CAS Name: 2-[[1-[(4-acetylanilino)-oxomethyl]-4-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[1-[(4-acetylphenyl)carbamoyl]piperidin-4-yl]sulfonylbenzoate Traditional Name: 2-[[1-[(4-acetylphenyl)carbamoyl]-4-piperidyl]sulfonyl]benzoic acid methyl ester Formula: C22H24N2O6S MolecularWeight: 444.50076

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)N2CCC(CC2)S(=O)(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)N2CCC(CC2)S(=O)(=O)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C22H24N2O6S/c1-15(25)16-7-9-17(10-8-16)23-22(27)24-13-11-18(12-14-24)31(28,29)20-6-4-3-5-19(20)21(26)30-2/h3-10,18H,11-14H2,1-2H3,(H,23,27)