methyl 2-[4-[(6-ethanoyl-1,3-benzodioxol-5-yl)carbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-[(6-ethanoyl-1,3-benzodioxol-5-yl)carbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-[(6-acetyl-1,3-benzodioxol-5-yl)carbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[[(6-acetyl-1,3-benzodioxol-5-yl)amino]-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[(6-acetyl-1,3-benzodioxol-5-yl)carbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-[(6-acetyl-1,3-benzodioxol-5-yl)carbamoyl]piperidino]sulfonylbenzoic acid methyl ester Formula: C23H24N2O8S MolecularWeight: 488.51026

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C(=O)OC)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C(=O)OC)OCO2

InChI

InChI=1S/C23H24N2O8S/c1-14(26)17-11-19-20(33-13-32-19)12-18(17)24-22(27)15-7-9-25(10-8-15)34(29,30)21-6-4-3-5-16(21)23(28)31-2/h3-6,11-12,15H,7-10,13H2,1-2H3,(H,24,27)