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

Systemtic Name: (1S,3S)-3-[(3-chlorophenyl)carbamoyl]-1,2,2-trimethyl-cyclopentane-1-carboxylate Openeye Name: (1S,3S)-3-[(3-chlorophenyl)carbamoyl]-1,2,2-trimethyl-cyclopentanecarboxylate CAS Name: (1S,3S)-3-[(3-chloroanilino)-oxomethyl]-1,2,2-trimethyl-1-cyclopentanecarboxylate IUPAC Name: (1S,3S)-3-[(3-chlorophenyl)carbamoyl]-1,2,2-trimethylcyclopentane-1-carboxylate Traditional Name: (1S,3S)-3-[(3-chlorophenyl)carbamoyl]-1,2,2-trimethyl-cyclopentanecarboxylate Formula: C16H19ClNO3- MolecularWeight: 308.77996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20ClNO3/c1-15(2)12(7-8-16(15,3)14(20)21)13(19)18-11-6-4-5-10(17)9-11/h4-6,9,12H,7-8H2,1-3H3,(H,18,19)(H,20,21)/p-1/t12-,16-/m1/s1