methyl 2-azanyl-3-(5-nitro-1H-indol-3-yl)propanoate

Systemtic Name: methyl 2-azanyl-3-(5-nitro-1H-indol-3-yl)propanoate Openeye Name: methyl 2-amino-3-(5-nitro-1H-indol-3-yl)propanoate CAS Name: 2-amino-3-(5-nitro-1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl 2-amino-3-(5-nitro-1H-indol-3-yl)propanoate Traditional Name: 2-amino-3-(5-nitro-1H-indol-3-yl)propionic acid methyl ester Formula: C12H13N3O4 MolecularWeight: 263.24932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13N3O4/c1-19-12(16)10(13)4-7-6-14-11-3-2-8(15(17)18)5-9(7)11/h2-3,5-6,10,14H,4,13H2,1H3