N-[6-methoxy-5-[3-methyl-3-(4-methylphenyl)-2-oxidanylidene-pyrrolidin-1-yl]-6-oxidanylidene-hexyl]-methyl-boronamidic acid

Systemtic Name: N-[6-methoxy-5-[3-methyl-3-(4-methylphenyl)-2-oxidanylidene-pyrrolidin-1-yl]-6-oxidanylidene-hexyl]-methyl-boronamidic acid Openeye Name: N-[6-methoxy-5-[3-methyl-2-oxo-3-(p-tolyl)pyrrolidin-1-yl]-6-oxo-hexyl]-methyl-boronamidic acid CAS Name: N-[6-methoxy-5-[3-methyl-3-(4-methylphenyl)-2-oxo-1-pyrrolidinyl]-6-oxohexyl]-methylboronamidic acid IUPAC Name: N-[6-methoxy-5-[3-methyl-3-(4-methylphenyl)-2-oxopyrrolidin-1-yl]-6-oxohexyl]-methylboronamidic acid Traditional Name: N-[6-keto-5-[2-keto-3-methyl-3-(p-tolyl)pyrrolidino]-6-methoxy-hexyl]-methyl-boronamidic acid Formula: C20H31BN2O4 MolecularWeight: 374.28214

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Descriptors Computed from Structure

Canonical SMILES:

B(C)(NCCCCC(C(=O)OC)N1CCC(C1=O)(C)C2=CC=C(C=C2)C)O

Isomeric SMILES

B(C)(NCCCCC(C(=O)OC)N1CCC(C1=O)(C)C2=CC=C(C=C2)C)O

InChI

InChI=1S/C20H31BN2O4/c1-15-8-10-16(11-9-15)20(2)12-14-23(19(20)25)17(18(24)27-4)7-5-6-13-22-21(3)26/h8-11,17,22,26H,5-7,12-14H2,1-4H3