methyl 4-[[4-[furan-2-ylmethyl(methylsulfonyl)amino]piperidin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[4-[furan-2-ylmethyl(methylsulfonyl)amino]piperidin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[4-[2-furylmethyl(methylsulfonyl)amino]-1-piperidyl]methyl]benzoate CAS Name: 4-[[4-[2-furanylmethyl(methylsulfonyl)amino]-1-piperidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[furan-2-ylmethyl(methylsulfonyl)amino]piperidin-1-yl]methyl]benzoate Traditional Name: 4-[[4-[2-furfuryl(mesyl)amino]piperidino]methyl]benzoic acid methyl ester Formula: C20H26N2O5S MolecularWeight: 406.49584

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN2CCC(CC2)N(CC3=CC=CO3)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN2CCC(CC2)N(CC3=CC=CO3)S(=O)(=O)C

InChI

InChI=1S/C20H26N2O5S/c1-26-20(23)17-7-5-16(6-8-17)14-21-11-9-18(10-12-21)22(28(2,24)25)15-19-4-3-13-27-19/h3-8,13,18H,9-12,14-15H2,1-2H3