N-(3-chlorophenyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1-carboxamide

Systemtic Name: N-(3-chlorophenyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1-carboxamide Openeye Name: N-(3-chlorophenyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1-carboxamide CAS Name: N-(3-chlorophenyl)-4-[(2,3,4-trimethoxyphenyl)methyl]-1-piperazinecarboxamide IUPAC Name: N-(3-chlorophenyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1-carboxamide Traditional Name: N-(3-chlorophenyl)-4-(2,3,4-trimethoxybenzyl)piperazine-1-carboxamide Formula: C21H26ClN3O4 MolecularWeight: 419.90184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CCN(CC2)C(=O)NC3=CC(=CC=C3)Cl)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CCN(CC2)C(=O)NC3=CC(=CC=C3)Cl)OC)OC

InChI

InChI=1S/C21H26ClN3O4/c1-27-18-8-7-15(19(28-2)20(18)29-3)14-24-9-11-25(12-10-24)21(26)23-17-6-4-5-16(22)13-17/h4-8,13H,9-12,14H2,1-3H3,(H,23,26)