methyl 2-[4-[methyl-[(5-methylfuran-2-yl)methyl]carbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-[methyl-[(5-methylfuran-2-yl)methyl]carbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-[methyl-[(5-methyl-2-furyl)methyl]carbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[[methyl-[(5-methyl-2-furanyl)methyl]amino]-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[methyl-[(5-methylfuran-2-yl)methyl]carbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-[methyl-[(5-methyl-2-furyl)methyl]carbamoyl]piperidino]sulfonylbenzoic acid methyl ester Formula: C21H26N2O6S MolecularWeight: 434.50594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN(C)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC1=CC=C(O1)CN(C)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C21H26N2O6S/c1-15-8-9-17(29-15)14-22(2)20(24)16-10-12-23(13-11-16)30(26,27)19-7-5-4-6-18(19)21(25)28-3/h4-9,16H,10-14H2,1-3H3