[1-(4-nitrophenyl)pyrrolidin-2-yl]methanethiol

Systemtic Name: [1-(4-nitrophenyl)pyrrolidin-2-yl]methanethiol Openeye Name: [1-(4-nitrophenyl)pyrrolidin-2-yl]methanethiol CAS Name: [1-(4-nitrophenyl)-2-pyrrolidinyl]methanethiol IUPAC Name: [1-(4-nitrophenyl)pyrrolidin-2-yl]methanethiol Traditional Name: [1-(4-nitrophenyl)pyrrolidin-2-yl]methanethiol Formula: C11H14N2O2S MolecularWeight: 238.30606

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=CC=C(C=C2)[N+](=O)[O-])CS

Isomeric SMILES

C1CC(N(C1)C2=CC=C(C=C2)[N+](=O)[O-])CS

InChI

InChI=1S/C11H14N2O2S/c14-13(15)10-5-3-9(4-6-10)12-7-1-2-11(12)8-16/h3-6,11,16H,1-2,7-8H2