5-nitro-1-prop-2-enyl-indole-2-thiol

Systemtic Name: 5-nitro-1-prop-2-enyl-indole-2-thiol Openeye Name: 1-allyl-5-nitro-indole-2-thiol CAS Name: 5-nitro-1-prop-2-enyl-2-indolethiol IUPAC Name: 5-nitro-1-prop-2-enylindole-2-thiol Traditional Name: 1-allyl-5-nitro-indole-2-thiol Formula: C11H10N2O2S MolecularWeight: 234.2743

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C=C1S

Isomeric SMILES

C=CCN1C2=C(C=C(C=C2)[N+](=O)[O-])C=C1S

InChI

InChI=1S/C11H10N2O2S/c1-2-5-12-10-4-3-9(13(14)15)6-8(10)7-11(12)16/h2-4,6-7,16H,1,5H2