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

Systemtic Name: N-(3-chloranyl-2-pyrrolidin-1-yl-phenyl)-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-(3-chloro-2-pyrrolidin-1-yl-phenyl)-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[3-chloro-2-(1-pyrrolidinyl)phenyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-(3-chloro-2-pyrrolidin-1-ylphenyl)-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-(3-chloro-2-pyrrolidino-phenyl)-3-nitro-4-pyrrolidino-benzamide Formula: C21H23ClN4O3 MolecularWeight: 414.88532

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=C(C(=CC=C3)Cl)N4CCCC4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=C(C(=CC=C3)Cl)N4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C21H23ClN4O3/c22-16-6-5-7-17(20(16)25-12-3-4-13-25)23-21(27)15-8-9-18(19(14-15)26(28)29)24-10-1-2-11-24/h5-9,14H,1-4,10-13H2,(H,23,27)