2-nitro-N-[phenyl(pyridin-2-yl)methyl]-4-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: 2-nitro-N-[phenyl(pyridin-2-yl)methyl]-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: 2-nitro-N-[phenyl(2-pyridyl)methyl]-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: 2-nitro-N-[phenyl(2-pyridinyl)methyl]-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: 2-nitro-N-[phenyl(pyridin-2-yl)methyl]-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: (2-nitro-4-pyrrolidinosulfonyl-phenyl)-[phenyl(2-pyridyl)methyl]amine Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NC(C3=CC=CC=C3)C4=CC=CC=N4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NC(C3=CC=CC=C3)C4=CC=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O4S/c27-26(28)21-16-18(31(29,30)25-14-6-7-15-25)11-12-19(21)24-22(17-8-2-1-3-9-17)20-10-4-5-13-23-20/h1-5,8-13,16,22,24H,6-7,14-15H2