3-[2-azanyl-3-(3-phenylmethoxyphenyl)propanoyl]oxycarbonyl-1,2,2-trimethyl-cyclopentane-1-carboxylic acid

Systemtic Name: 3-[2-azanyl-3-(3-phenylmethoxyphenyl)propanoyl]oxycarbonyl-1,2,2-trimethyl-cyclopentane-1-carboxylic acid Openeye Name: 3-[2-amino-3-(3-benzyloxyphenyl)propanoyl]oxycarbonyl-1,2,2-trimethyl-cyclopentanecarboxylic acid CAS Name: 3-[[2-amino-1-oxo-3-(3-phenylmethoxyphenyl)propoxy]-oxomethyl]-1,2,2-trimethyl-1-cyclopentanecarboxylic acid IUPAC Name: 3-[2-amino-3-(3-phenylmethoxyphenyl)propanoyl]oxycarbonyl-1,2,2-trimethylcyclopentane-1-carboxylic acid Traditional Name: 3-[2-amino-3-(3-benzoxyphenyl)propanoyl]oxycarbonyl-1,2,2-trimethyl-cyclopentanecarboxylic acid Formula: C26H31NO6 MolecularWeight: 453.52744

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCC1(C)C(=O)O)C(=O)OC(=O)C(CC2=CC(=CC=C2)OCC3=CC=CC=C3)N)C

Isomeric SMILES

CC1(C(CCC1(C)C(=O)O)C(=O)OC(=O)C(CC2=CC(=CC=C2)OCC3=CC=CC=C3)N)C

InChI

InChI=1S/C26H31NO6/c1-25(2)20(12-13-26(25,3)24(30)31)22(28)33-23(29)21(27)15-18-10-7-11-19(14-18)32-16-17-8-5-4-6-9-17/h4-11,14,20-21H,12-13,15-16,27H2,1-3H3,(H,30,31)