methyl 3-phenyl-3-[(5-piperidin-1-ylsulfonylfuran-2-yl)carbonylamino]propanoate

Systemtic Name: methyl 3-phenyl-3-[(5-piperidin-1-ylsulfonylfuran-2-yl)carbonylamino]propanoate Openeye Name: methyl 3-phenyl-3-[[5-(1-piperidylsulfonyl)furan-2-carbonyl]amino]propanoate CAS Name: 3-[[oxo-[5-(1-piperidinylsulfonyl)-2-furanyl]methyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-phenyl-3-[(5-piperidin-1-ylsulfonylfuran-2-carbonyl)amino]propanoate Traditional Name: 3-phenyl-3-[(5-piperidinosulfonyl-2-furoyl)amino]propionic acid methyl ester Formula: C20H24N2O6S MolecularWeight: 420.47936

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC=C(O2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC=C(O2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H24N2O6S/c1-27-18(23)14-16(15-8-4-2-5-9-15)21-20(24)17-10-11-19(28-17)29(25,26)22-12-6-3-7-13-22/h2,4-5,8-11,16H,3,6-7,12-14H2,1H3,(H,21,24)