[4-(3-chlorophenyl)piperazin-1-yl]-(5-nitro-2-pyrrolidin-1-yl-phenyl)methanone

Systemtic Name: [4-(3-chlorophenyl)piperazin-1-yl]-(5-nitro-2-pyrrolidin-1-yl-phenyl)methanone Openeye Name: [4-(3-chlorophenyl)piperazin-1-yl]-(5-nitro-2-pyrrolidin-1-yl-phenyl)methanone CAS Name: [4-(3-chlorophenyl)-1-piperazinyl]-[5-nitro-2-(1-pyrrolidinyl)phenyl]methanone IUPAC Name: [4-(3-chlorophenyl)piperazin-1-yl]-(5-nitro-2-pyrrolidin-1-ylphenyl)methanone Traditional Name: [4-(3-chlorophenyl)piperazino]-(5-nitro-2-pyrrolidino-phenyl)methanone Formula: C21H23ClN4O3 MolecularWeight: 414.88532

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H23ClN4O3/c22-16-4-3-5-17(14-16)23-10-12-25(13-11-23)21(27)19-15-18(26(28)29)6-7-20(19)24-8-1-2-9-24/h3-7,14-15H,1-2,8-13H2