methyl (2S)-2-[[1-(furan-3-ylcarbonyl)piperidin-3-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[[1-(furan-3-ylcarbonyl)piperidin-3-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[1-(furan-3-carbonyl)piperidine-3-carbonyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[[1-[3-furanyl(oxo)methyl]-3-piperidinyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[1-(furan-3-carbonyl)piperidine-3-carbonyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[1-(3-furoyl)nipecotoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2CCCN(C2)C(=O)C3=COC=C3

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C2CCCN(C2)C(=O)C3=COC=C3

InChI

InChI=1S/C21H24N2O5/c1-27-21(26)18(12-15-6-3-2-4-7-15)22-19(24)16-8-5-10-23(13-16)20(25)17-9-11-28-14-17/h2-4,6-7,9,11,14,16,18H,5,8,10,12-13H2,1H3,(H,22,24)/t16?,18-/m0/s1