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

Systemtic Name: N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)-3-nitro-4-pyrrolidino-benzamide Formula: C21H23ClN4O5S MolecularWeight: 478.94912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23ClN4O5S/c22-17-7-6-16(14-20(17)32(30,31)25-11-3-4-12-25)23-21(27)15-5-8-18(19(13-15)26(28)29)24-9-1-2-10-24/h5-8,13-14H,1-4,9-12H2,(H,23,27)