2-aminocarbonyl-3-(3-methylbutyl)-3-[phenyl(phenylmethoxy)methyl]oxirane-2-carboxylic acid

Systemtic Name: 2-aminocarbonyl-3-(3-methylbutyl)-3-[phenyl(phenylmethoxy)methyl]oxirane-2-carboxylic acid Openeye Name: 3-[benzyloxy(phenyl)methyl]-2-carbamoyl-3-isopentyl-oxirane-2-carboxylic acid CAS Name: 2-carbamoyl-3-(3-methylbutyl)-3-[phenyl(phenylmethoxy)methyl]-2-oxiranecarboxylic acid IUPAC Name: 2-carbamoyl-3-(3-methylbutyl)-3-[phenyl(phenylmethoxy)methyl]oxirane-2-carboxylic acid Traditional Name: 3-[benzoxy(phenyl)methyl]-2-carbamoyl-3-isoamyl-oxirane-2-carboxylic acid Formula: C23H27NO5 MolecularWeight: 397.46418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1(C(O1)(C(=O)N)C(=O)O)C(C2=CC=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)CCC1(C(O1)(C(=O)N)C(=O)O)C(C2=CC=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C23H27NO5/c1-16(2)13-14-22(23(29-22,20(24)25)21(26)27)19(18-11-7-4-8-12-18)28-15-17-9-5-3-6-10-17/h3-12,16,19H,13-15H2,1-2H3,(H2,24,25)(H,26,27)