methyl 3-[(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)carbonyl-(2-methylpropyl)amino]propanoate

Systemtic Name: methyl 3-[(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)carbonyl-(2-methylpropyl)amino]propanoate Openeye Name: methyl 3-[isobutyl-(4-methoxy-3-morpholinosulfonyl-benzoyl)amino]propanoate CAS Name: 3-[[[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]-(2-methylpropyl)amino]propanoic acid methyl ester IUPAC Name: methyl 3-[(4-methoxy-3-morpholin-4-ylsulfonylbenzoyl)-(2-methylpropyl)amino]propanoate Traditional Name: 3-[isobutyl-(4-methoxy-3-morpholinosulfonyl-benzoyl)amino]propionic acid methyl ester Formula: C20H30N2O7S MolecularWeight: 442.5264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CCC(=O)OC)C(=O)C1=CC(=C(C=C1)OC)S(=O)(=O)N2CCOCC2

Isomeric SMILES

CC(C)CN(CCC(=O)OC)C(=O)C1=CC(=C(C=C1)OC)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C20H30N2O7S/c1-15(2)14-21(8-7-19(23)28-4)20(24)16-5-6-17(27-3)18(13-16)30(25,26)22-9-11-29-12-10-22/h5-6,13,15H,7-12,14H2,1-4H3