(3S)-3-(1H-indol-3-yl)-1-methoxy-2-nitro-but-1-en-1-ol

Systemtic Name: (3S)-3-(1H-indol-3-yl)-1-methoxy-2-nitro-but-1-en-1-ol Openeye Name: (3S)-3-(1H-indol-3-yl)-1-methoxy-2-nitro-but-1-en-1-ol CAS Name: (3S)-3-(1H-indol-3-yl)-1-methoxy-2-nitro-1-buten-1-ol IUPAC Name: (3S)-3-(1H-indol-3-yl)-1-methoxy-2-nitrobut-1-en-1-ol Traditional Name: (3S)-3-(1H-indol-3-yl)-1-methoxy-2-nitro-but-1-en-1-ol Formula: C13H14N2O4 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CNC2=CC=CC=C21)C(=C(O)OC)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C1=CNC2=CC=CC=C21)C(=C(O)OC)[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O4/c1-8(12(15(17)18)13(16)19-2)10-7-14-11-6-4-3-5-9(10)11/h3-8,14,16H,1-2H3/t8-/m0/s1