N-(2-chloranyl-4-nitro-phenyl)-2-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]propanamide

Systemtic Name: N-(2-chloranyl-4-nitro-phenyl)-2-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidin-1-yl]propanamide Openeye Name: N-(2-chloro-4-nitro-phenyl)-2-[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidyl]propanamide CAS Name: N-(2-chloro-4-nitrophenyl)-2-[4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidinyl]propanamide IUPAC Name: N-(2-chloro-4-nitrophenyl)-2-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]propanamide Traditional Name: N-(2-chloro-4-nitro-phenyl)-2-[4-(2-keto-3H-benzimidazol-1-yl)piperidino]propionamide Formula: C21H22ClN5O4 MolecularWeight: 443.88348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])Cl)N2CCC(CC2)N3C4=CC=CC=C4NC3=O

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])Cl)N2CCC(CC2)N3C4=CC=CC=C4NC3=O

InChI

InChI=1S/C21H22ClN5O4/c1-13(20(28)23-17-7-6-15(27(30)31)12-16(17)22)25-10-8-14(9-11-25)26-19-5-3-2-4-18(19)24-21(26)29/h2-7,12-14H,8-11H2,1H3,(H,23,28)(H,24,29)