(1S,3S)-1,2,2-trimethyl-3-[(4-phenoxyphenyl)carbamoyl]cyclopentane-1-carboxylate

Systemtic Name: (1S,3S)-1,2,2-trimethyl-3-[(4-phenoxyphenyl)carbamoyl]cyclopentane-1-carboxylate Openeye Name: (1S,3S)-1,2,2-trimethyl-3-[(4-phenoxyphenyl)carbamoyl]cyclopentanecarboxylate CAS Name: (1S,3S)-1,2,2-trimethyl-3-[oxo-(4-phenoxyanilino)methyl]-1-cyclopentanecarboxylate IUPAC Name: (1S,3S)-1,2,2-trimethyl-3-[(4-phenoxyphenyl)carbamoyl]cyclopentane-1-carboxylate Traditional Name: (1S,3S)-1,2,2-trimethyl-3-[(4-phenoxyphenyl)carbamoyl]cyclopentanecarboxylate Formula: C22H24NO4- MolecularWeight: 366.43026

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCC1(C)C(=O)[O-])C(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)C

Isomeric SMILES

C[C@@]1(CC[C@@H](C1(C)C)C(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C22H25NO4/c1-21(2)18(13-14-22(21,3)20(25)26)19(24)23-15-9-11-17(12-10-15)27-16-7-5-4-6-8-16/h4-12,18H,13-14H2,1-3H3,(H,23,24)(H,25,26)/p-1/t18-,22-/m1/s1