butyl 2-[[4-(3,4-dichlorophenyl)piperazin-1-yl]carbonylamino]benzoate

Systemtic Name: butyl 2-[[4-(3,4-dichlorophenyl)piperazin-1-yl]carbonylamino]benzoate Openeye Name: butyl 2-[[4-(3,4-dichlorophenyl)piperazine-1-carbonyl]amino]benzoate CAS Name: 2-[[[4-(3,4-dichlorophenyl)-1-piperazinyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 2-[[4-(3,4-dichlorophenyl)piperazine-1-carbonyl]amino]benzoate Traditional Name: 2-[[4-(3,4-dichlorophenyl)piperazine-1-carbonyl]amino]benzoic acid butyl ester Formula: C22H25Cl2N3O3 MolecularWeight: 450.3582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=CC=C1NC(=O)N2CCN(CC2)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CCCCOC(=O)C1=CC=CC=C1NC(=O)N2CCN(CC2)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H25Cl2N3O3/c1-2-3-14-30-21(28)17-6-4-5-7-20(17)25-22(29)27-12-10-26(11-13-27)16-8-9-18(23)19(24)15-16/h4-9,15H,2-3,10-14H2,1H3,(H,25,29)