ethyl 4-[1-[(5-chloranyl-2,3-dimethoxy-phenyl)methyl]piperidin-3-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-[(5-chloranyl-2,3-dimethoxy-phenyl)methyl]piperidin-3-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[1-[(5-chloro-2,3-dimethoxy-phenyl)methyl]-3-piperidyl]piperazine-1-carboxylate CAS Name: 4-[1-[(5-chloro-2,3-dimethoxyphenyl)methyl]-3-piperidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-[(5-chloro-2,3-dimethoxyphenyl)methyl]piperidin-3-yl]piperazine-1-carboxylate Traditional Name: 4-[1-(5-chloro-2,3-dimethoxy-benzyl)-3-piperidyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H32ClN3O4 MolecularWeight: 425.94948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2CCCN(C2)CC3=CC(=CC(=C3OC)OC)Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2CCCN(C2)CC3=CC(=CC(=C3OC)OC)Cl

InChI

InChI=1S/C21H32ClN3O4/c1-4-29-21(26)25-10-8-24(9-11-25)18-6-5-7-23(15-18)14-16-12-17(22)13-19(27-2)20(16)28-3/h12-13,18H,4-11,14-15H2,1-3H3