[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-(2-pyrrolidin-1-ylpyridin-3-yl)methanone

Systemtic Name: [4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]-(2-pyrrolidin-1-ylpyridin-3-yl)methanone Openeye Name: [4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]-(2-pyrrolidin-1-yl-3-pyridyl)methanone CAS Name: [4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-[2-(1-pyrrolidinyl)-3-pyridinyl]methanone IUPAC Name: [4-(4-chloro-2-nitrophenyl)piperazin-1-yl]-(2-pyrrolidin-1-ylpyridin-3-yl)methanone Traditional Name: [4-(4-chloro-2-nitro-phenyl)piperazino]-(2-pyrrolidino-3-pyridyl)methanone Formula: C20H22ClN5O3 MolecularWeight: 415.87338

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=CC=N2)C(=O)N3CCN(CC3)C4=C(C=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=CC=N2)C(=O)N3CCN(CC3)C4=C(C=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H22ClN5O3/c21-15-5-6-17(18(14-15)26(28)29)23-10-12-25(13-11-23)20(27)16-4-3-7-22-19(16)24-8-1-2-9-24/h3-7,14H,1-2,8-13H2