3-[[1-methoxy-1-oxidanylidene-3-(4-phenylmethoxyphenyl)propan-2-yl]carbamoyl]-1,2,2-trimethyl-cyclopentane-1-carboxylic acid

Systemtic Name: 3-[[1-methoxy-1-oxidanylidene-3-(4-phenylmethoxyphenyl)propan-2-yl]carbamoyl]-1,2,2-trimethyl-cyclopentane-1-carboxylic acid Openeye Name: 3-[[1-[(4-benzyloxyphenyl)methyl]-2-methoxy-2-oxo-ethyl]carbamoyl]-1,2,2-trimethyl-cyclopentanecarboxylic acid CAS Name: 3-[[[1-methoxy-1-oxo-3-(4-phenylmethoxyphenyl)propan-2-yl]amino]-oxomethyl]-1,2,2-trimethyl-1-cyclopentanecarboxylic acid IUPAC Name: 3-[[1-methoxy-1-oxo-3-(4-phenylmethoxyphenyl)propan-2-yl]carbamoyl]-1,2,2-trimethylcyclopentane-1-carboxylic acid Traditional Name: 3-[[1-(4-benzoxybenzyl)-2-keto-2-methoxy-ethyl]carbamoyl]-1,2,2-trimethyl-cyclopentanecarboxylic acid Formula: C27H33NO6 MolecularWeight: 467.55402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H33NO6/c1-26(2)21(14-15-27(26,3)25(31)32)23(29)28-22(24(30)33-4)16-18-10-12-20(13-11-18)34-17-19-8-6-5-7-9-19/h5-13,21-22H,14-17H2,1-4H3,(H,28,29)(H,31,32)