sodium 4-[(2-chlorophenyl)amino]-1-[(2-chlorophenyl)methyl]piperidine-4-carboxylate

Systemtic Name: sodium 4-[(2-chlorophenyl)amino]-1-[(2-chlorophenyl)methyl]piperidine-4-carboxylate Openeye Name: sodium 4-(2-chloroanilino)-1-[(2-chlorophenyl)methyl]piperidine-4-carboxylate CAS Name: sodium 4-(2-chloroanilino)-1-[(2-chlorophenyl)methyl]-4-piperidinecarboxylate IUPAC Name: sodium 4-(2-chloroanilino)-1-[(2-chlorophenyl)methyl]piperidine-4-carboxylate Traditional Name: sodium 4-(2-chloroanilino)-1-(2-chlorobenzyl)isonipecotate Formula: C19H19Cl2N2NaO2 MolecularWeight: 401.26213

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C(=O)[O-])NC2=CC=CC=C2Cl)CC3=CC=CC=C3Cl.[Na+]

Isomeric SMILES

C1CN(CCC1(C(=O)[O-])NC2=CC=CC=C2Cl)CC3=CC=CC=C3Cl.[Na+]

InChI

InChI=1S/C19H20Cl2N2O2.Na/c20-15-6-2-1-5-14(15)13-23-11-9-19(10-12-23,18(24)25)22-17-8-4-3-7-16(17)21;/h1-8,22H,9-13H2,(H,24,25);/q;+1/p-1