N-(2-chloranyl-5-nitro-phenyl)-2-(4-cyclopropylcarbonylpiperazin-1-yl)propanamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-2-(4-cyclopropylcarbonylpiperazin-1-yl)propanamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanamide CAS Name: N-(2-chloro-5-nitrophenyl)-2-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]propanamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-2-[4-(cyclopropanecarbonyl)piperazino]propionamide Formula: C17H21ClN4O4 MolecularWeight: 380.82604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl)N2CCN(CC2)C(=O)C3CC3

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl)N2CCN(CC2)C(=O)C3CC3

InChI

InChI=1S/C17H21ClN4O4/c1-11(20-6-8-21(9-7-20)17(24)12-2-3-12)16(23)19-15-10-13(22(25)26)4-5-14(15)18/h4-5,10-12H,2-3,6-9H2,1H3,(H,19,23)