N-[2-(4-nitrophenyl)propyl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-(4-nitrophenyl)propyl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(4-nitrophenyl)propyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-(4-nitrophenyl)propyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[2-(4-nitrophenyl)propyl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(4-nitrophenyl)propyl]-4-pyrrolidinosulfonyl-benzamide Formula: C20H23N3O5S MolecularWeight: 417.47872

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(CNC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O5S/c1-15(16-4-8-18(9-5-16)23(25)26)14-21-20(24)17-6-10-19(11-7-17)29(27,28)22-12-2-3-13-22/h4-11,15H,2-3,12-14H2,1H3,(H,21,24)