(1S,3S)-1,2,2-trimethyl-3-[(4-phenylmethoxyphenyl)carbamoyl]cyclopentane-1-carboxylic acid

Systemtic Name: (1S,3S)-1,2,2-trimethyl-3-[(4-phenylmethoxyphenyl)carbamoyl]cyclopentane-1-carboxylic acid Openeye Name: (1S,3S)-3-[(4-benzyloxyphenyl)carbamoyl]-1,2,2-trimethyl-cyclopentanecarboxylic acid CAS Name: (1S,3S)-1,2,2-trimethyl-3-[oxo-(4-phenylmethoxyanilino)methyl]-1-cyclopentanecarboxylic acid IUPAC Name: (1S,3S)-1,2,2-trimethyl-3-[(4-phenylmethoxyphenyl)carbamoyl]cyclopentane-1-carboxylic acid Traditional Name: (1S,3S)-3-[(4-benzoxyphenyl)carbamoyl]-1,2,2-trimethyl-cyclopentanecarboxylic acid Formula: C23H27NO4 MolecularWeight: 381.46478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCC1(C)C(=O)O)C(=O)NC2=CC=C(C=C2)OCC3=CC=CC=C3)C

Isomeric SMILES

C[C@@]1(CC[C@@H](C1(C)C)C(=O)NC2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C23H27NO4/c1-22(2)19(13-14-23(22,3)21(26)27)20(25)24-17-9-11-18(12-10-17)28-15-16-7-5-4-6-8-16/h4-12,19H,13-15H2,1-3H3,(H,24,25)(H,26,27)/t19-,23-/m1/s1