ethyl (2S)-2-azanyl-3-(7-bromanyl-1H-indol-3-yl)propanoate

Systemtic Name: ethyl (2S)-2-azanyl-3-(7-bromanyl-1H-indol-3-yl)propanoate Openeye Name: ethyl (2S)-2-amino-3-(7-bromo-1H-indol-3-yl)propanoate CAS Name: (2S)-2-amino-3-(7-bromo-1H-indol-3-yl)propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-amino-3-(7-bromo-1H-indol-3-yl)propanoate Traditional Name: (2S)-2-amino-3-(7-bromo-1H-indol-3-yl)propionic acid ethyl ester Formula: C13H15BrN2O2 MolecularWeight: 311.1744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CNC2=C1C=CC=C2Br)N

Isomeric SMILES

CCOC(=O)[C@H](CC1=CNC2=C1C=CC=C2Br)N

InChI

InChI=1S/C13H15BrN2O2/c1-2-18-13(17)11(15)6-8-7-16-12-9(8)4-3-5-10(12)14/h3-5,7,11,16H,2,6,15H2,1H3/t11-/m0/s1