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

Systemtic Name: 3-nitro-N-(3-piperidin-1-ylsulfonylphenyl)-4-pyrrolidin-1-yl-benzamide Openeye Name: 3-nitro-N-[3-(1-piperidylsulfonyl)phenyl]-4-pyrrolidin-1-yl-benzamide CAS Name: 3-nitro-N-[3-(1-piperidinylsulfonyl)phenyl]-4-(1-pyrrolidinyl)benzamide IUPAC Name: 3-nitro-N-(3-piperidin-1-ylsulfonylphenyl)-4-pyrrolidin-1-ylbenzamide Traditional Name: 3-nitro-N-(3-piperidinosulfonylphenyl)-4-pyrrolidino-benzamide Formula: C22H26N4O5S MolecularWeight: 458.53064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4O5S/c27-22(17-9-10-20(21(15-17)26(28)29)24-11-4-5-12-24)23-18-7-6-8-19(16-18)32(30,31)25-13-2-1-3-14-25/h6-10,15-16H,1-5,11-14H2,(H,23,27)