methyl (2S)-2-azanyl-3-[6-[(2-nitrophenyl)methoxy]-1H-indol-3-yl]propanoate

Systemtic Name: methyl (2S)-2-azanyl-3-[6-[(2-nitrophenyl)methoxy]-1H-indol-3-yl]propanoate Openeye Name: methyl (2S)-2-amino-3-[6-[(2-nitrophenyl)methoxy]-1H-indol-3-yl]propanoate CAS Name: (2S)-2-amino-3-[6-[(2-nitrophenyl)methoxy]-1H-indol-3-yl]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-amino-3-[6-[(2-nitrophenyl)methoxy]-1H-indol-3-yl]propanoate Traditional Name: (2S)-2-amino-3-[6-(2-nitrobenzyl)oxy-1H-indol-3-yl]propionic acid methyl ester Formula: C19H19N3O5 MolecularWeight: 369.37126

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=C1C=CC(=C2)OCC3=CC=CC=C3[N+](=O)[O-])N

Isomeric SMILES

COC(=O)[C@H](CC1=CNC2=C1C=CC(=C2)OCC3=CC=CC=C3[N+](=O)[O-])N

InChI

InChI=1S/C19H19N3O5/c1-26-19(23)16(20)8-13-10-21-17-9-14(6-7-15(13)17)27-11-12-4-2-3-5-18(12)22(24)25/h2-7,9-10,16,21H,8,11,20H2,1H3/t16-/m0/s1