N-(3-chloranyl-4-piperidin-1-yl-phenyl)-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(3-chloranyl-4-piperidin-1-yl-phenyl)-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[3-chloro-4-(1-piperidyl)phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[3-chloro-4-(1-piperidinyl)phenyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-(3-chloro-4-piperidin-1-ylphenyl)-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-(3-chloro-4-piperidino-phenyl)-3-nitro-4-pyrrolidino-benzamide Formula: C22H25ClN4O3 MolecularWeight: 428.9119

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-])Cl

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-])Cl

InChI

InChI=1S/C22H25ClN4O3/c23-18-15-17(7-9-19(18)25-10-2-1-3-11-25)24-22(28)16-6-8-20(21(14-16)27(29)30)26-12-4-5-13-26/h6-9,14-15H,1-5,10-13H2,(H,24,28)