4-(5-chloranyl-2-methyl-phenyl)-N-[(3,4-dimethoxyphenyl)methyl]piperazine-1-carboxamide

Systemtic Name: 4-(5-chloranyl-2-methyl-phenyl)-N-[(3,4-dimethoxyphenyl)methyl]piperazine-1-carboxamide Openeye Name: 4-(5-chloro-2-methyl-phenyl)-N-[(3,4-dimethoxyphenyl)methyl]piperazine-1-carboxamide CAS Name: 4-(5-chloro-2-methylphenyl)-N-[(3,4-dimethoxyphenyl)methyl]-1-piperazinecarboxamide IUPAC Name: 4-(5-chloro-2-methylphenyl)-N-[(3,4-dimethoxyphenyl)methyl]piperazine-1-carboxamide Traditional Name: 4-(5-chloro-2-methyl-phenyl)-N-veratryl-piperazine-1-carboxamide Formula: C21H26ClN3O3 MolecularWeight: 403.90244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)NCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)NCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H26ClN3O3/c1-15-4-6-17(22)13-18(15)24-8-10-25(11-9-24)21(26)23-14-16-5-7-19(27-2)20(12-16)28-3/h4-7,12-13H,8-11,14H2,1-3H3,(H,23,26)