N-[[3-[(E)-2-nitroprop-1-enyl]-1H-indol-5-yl]methyl]methanesulfonamide

Systemtic Name: N-[[3-[(E)-2-nitroprop-1-enyl]-1H-indol-5-yl]methyl]methanesulfonamide Openeye Name: N-[[3-[(E)-2-nitroprop-1-enyl]-1H-indol-5-yl]methyl]methanesulfonamide CAS Name: N-[[3-[(E)-2-nitroprop-1-enyl]-1H-indol-5-yl]methyl]methanesulfonamide IUPAC Name: N-[[3-[(E)-2-nitroprop-1-enyl]-1H-indol-5-yl]methyl]methanesulfonamide Traditional Name: N-[[3-[(E)-2-nitroprop-1-enyl]-1H-indol-5-yl]methyl]methanesulfonamide Formula: C13H15N3O4S MolecularWeight: 309.3409

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CNC2=C1C=C(C=C2)CNS(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

C/C(=C\C1=CNC2=C1C=C(C=C2)CNS(=O)(=O)C)/[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O4S/c1-9(16(17)18)5-11-8-14-13-4-3-10(6-12(11)13)7-15-21(2,19)20/h3-6,8,14-15H,7H2,1-2H3/b9-5+