8-(2-nitro-5-pyrrolidin-1-yl-phenyl)sulfanylquinoline

Systemtic Name: 8-(2-nitro-5-pyrrolidin-1-yl-phenyl)sulfanylquinoline Openeye Name: 8-(2-nitro-5-pyrrolidin-1-yl-phenyl)sulfanylquinoline CAS Name: 8-[[2-nitro-5-(1-pyrrolidinyl)phenyl]thio]quinoline IUPAC Name: 8-(2-nitro-5-pyrrolidin-1-ylphenyl)sulfanylquinoline Traditional Name: 8-[(2-nitro-5-pyrrolidino-phenyl)thio]quinoline Formula: C19H17N3O2S MolecularWeight: 351.42218

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC(=C(C=C2)[N+](=O)[O-])SC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C1CCN(C1)C2=CC(=C(C=C2)[N+](=O)[O-])SC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C19H17N3O2S/c23-22(24)16-9-8-15(21-11-1-2-12-21)13-18(16)25-17-7-3-5-14-6-4-10-20-19(14)17/h3-10,13H,1-2,11-12H2