N-(3-chloranyl-2-piperidin-1-yl-phenyl)-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(3-chloranyl-2-piperidin-1-yl-phenyl)-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[3-chloro-2-(1-piperidyl)phenyl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[3-chloro-2-(1-piperidinyl)phenyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-(3-chloro-2-piperidin-1-ylphenyl)-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-(3-chloro-2-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=CC=C2Cl)NC(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)C3=CC(=C(C=C3)N4CCCC4)[N+](=O)[O-]

InChI

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