methyl 2-[cyclobutylcarbonyl(4-methylsulfonylbutyl)amino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[cyclobutylcarbonyl(4-methylsulfonylbutyl)amino]-3-phenyl-propanoate Openeye Name: methyl 2-[cyclobutanecarbonyl(4-methylsulfonylbutyl)amino]-3-phenyl-propanoate CAS Name: 2-[[cyclobutyl(oxo)methyl]-(4-methylsulfonylbutyl)amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[cyclobutanecarbonyl(4-methylsulfonylbutyl)amino]-3-phenylpropanoate Traditional Name: 2-[cyclobutanecarbonyl(4-mesylbutyl)amino]-3-phenyl-propionic acid methyl ester Formula: C20H29NO5S MolecularWeight: 395.51296

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)N(CCCCS(=O)(=O)C)C(=O)C2CCC2

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)N(CCCCS(=O)(=O)C)C(=O)C2CCC2

InChI

InChI=1S/C20H29NO5S/c1-26-20(23)18(15-16-9-4-3-5-10-16)21(19(22)17-11-8-12-17)13-6-7-14-27(2,24)25/h3-5,9-10,17-18H,6-8,11-15H2,1-2H3