methyl 2-(1H-indol-3-yl)-3-nitro-propanoate

Systemtic Name: methyl 2-(1H-indol-3-yl)-3-nitro-propanoate Openeye Name: methyl 2-(1H-indol-3-yl)-3-nitro-propanoate CAS Name: 2-(1H-indol-3-yl)-3-nitropropanoic acid methyl ester IUPAC Name: methyl 2-(1H-indol-3-yl)-3-nitropropanoate Traditional Name: 2-(1H-indol-3-yl)-3-nitro-propionic acid methyl ester Formula: C12H12N2O4 MolecularWeight: 248.23468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O4/c1-18-12(15)10(7-14(16)17)9-6-13-11-5-3-2-4-8(9)11/h2-6,10,13H,7H2,1H3