methyl (2S)-2-acetamido-3-[2,4,6-tris(bromanyl)-5-methoxy-1H-indol-3-yl]propanoate

Systemtic Name: methyl (2S)-2-acetamido-3-[2,4,6-tris(bromanyl)-5-methoxy-1H-indol-3-yl]propanoate Openeye Name: methyl (2S)-2-acetamido-3-(2,4,6-tribromo-5-methoxy-1H-indol-3-yl)propanoate CAS Name: (2S)-2-acetamido-3-(2,4,6-tribromo-5-methoxy-1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-acetamido-3-(2,4,6-tribromo-5-methoxy-1H-indol-3-yl)propanoate Traditional Name: (2S)-2-acetamido-3-(2,4,6-tribromo-5-methoxy-1H-indol-3-yl)propionic acid methyl ester Formula: C15H15Br3N2O4 MolecularWeight: 527.0026

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=C(NC2=CC(=C(C(=C21)Br)OC)Br)Br)C(=O)OC

Isomeric SMILES

CC(=O)N[C@@H](CC1=C(NC2=CC(=C(C(=C21)Br)OC)Br)Br)C(=O)OC

InChI

InChI=1S/C15H15Br3N2O4/c1-6(21)19-10(15(22)24-3)4-7-11-9(20-14(7)18)5-8(16)13(23-2)12(11)17/h5,10,20H,4H2,1-3H3,(H,19,21)/t10-/m0/s1