4-(4-chlorophenyl)-3-(naphthalen-2-ylmethoxy)-5-pentan-3-yl-piperidine-1-carboxylate

Systemtic Name: 4-(4-chlorophenyl)-3-(naphthalen-2-ylmethoxy)-5-pentan-3-yl-piperidine-1-carboxylate Openeye Name: 4-(4-chlorophenyl)-3-(1-ethylpropyl)-5-(2-naphthylmethoxy)piperidine-1-carboxylate CAS Name: 4-(4-chlorophenyl)-3-(2-naphthalenylmethoxy)-5-pentan-3-yl-1-piperidinecarboxylate IUPAC Name: 4-(4-chlorophenyl)-3-(naphthalen-2-ylmethoxy)-5-pentan-3-ylpiperidine-1-carboxylate Traditional Name: 4-(4-chlorophenyl)-3-(1-ethylpropyl)-5-(2-naphthylmethoxy)piperidine-1-carboxylate Formula: C28H31ClNO3- MolecularWeight: 465.00364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1CN(CC(C1C2=CC=C(C=C2)Cl)OCC3=CC4=CC=CC=C4C=C3)C(=O)[O-]

Isomeric SMILES

CCC(CC)C1CN(CC(C1C2=CC=C(C=C2)Cl)OCC3=CC4=CC=CC=C4C=C3)C(=O)[O-]

InChI

InChI=1S/C28H32ClNO3/c1-3-20(4-2)25-16-30(28(31)32)17-26(27(25)22-11-13-24(29)14-12-22)33-18-19-9-10-21-7-5-6-8-23(21)15-19/h5-15,20,25-27H,3-4,16-18H2,1-2H3,(H,31,32)/p-1