4-(3,4-dichlorophenyl)-N-(2-ethyl-6-propan-2-yl-phenyl)piperazine-1-carboxamide

Systemtic Name: 4-(3,4-dichlorophenyl)-N-(2-ethyl-6-propan-2-yl-phenyl)piperazine-1-carboxamide Openeye Name: 4-(3,4-dichlorophenyl)-N-(2-ethyl-6-isopropyl-phenyl)piperazine-1-carboxamide CAS Name: 4-(3,4-dichlorophenyl)-N-(2-ethyl-6-propan-2-ylphenyl)-1-piperazinecarboxamide IUPAC Name: 4-(3,4-dichlorophenyl)-N-(2-ethyl-6-propan-2-ylphenyl)piperazine-1-carboxamide Traditional Name: 4-(3,4-dichlorophenyl)-N-(2-ethyl-6-isopropyl-phenyl)piperazine-1-carboxamide Formula: C22H27Cl2N3O MolecularWeight: 420.37528

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)C(C)C)NC(=O)N2CCN(CC2)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CCC1=C(C(=CC=C1)C(C)C)NC(=O)N2CCN(CC2)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H27Cl2N3O/c1-4-16-6-5-7-18(15(2)3)21(16)25-22(28)27-12-10-26(11-13-27)17-8-9-19(23)20(24)14-17/h5-9,14-15H,4,10-13H2,1-3H3,(H,25,28)