4-(4-nitrophenyl)butyl 4-(2-chlorophenyl)piperazine-1-carboxylate

Systemtic Name: 4-(4-nitrophenyl)butyl 4-(2-chlorophenyl)piperazine-1-carboxylate Openeye Name: 4-(4-nitrophenyl)butyl 4-(2-chlorophenyl)piperazine-1-carboxylate CAS Name: 4-(2-chlorophenyl)-1-piperazinecarboxylic acid 4-(4-nitrophenyl)butyl ester IUPAC Name: 4-(4-nitrophenyl)butyl 4-(2-chlorophenyl)piperazine-1-carboxylate Traditional Name: 4-(2-chlorophenyl)piperazine-1-carboxylic acid 4-(4-nitrophenyl)butyl ester Formula: C21H24ClN3O4 MolecularWeight: 417.88596

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2Cl)C(=O)OCCCCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2Cl)C(=O)OCCCCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H24ClN3O4/c22-19-6-1-2-7-20(19)23-12-14-24(15-13-23)21(26)29-16-4-3-5-17-8-10-18(11-9-17)25(27)28/h1-2,6-11H,3-5,12-16H2