(2S)-3-(5-bromanyl-1H-indol-3-yl)-2-[(2-bromophenyl)carbonylamino]propanoic acid

Systemtic Name: (2S)-3-(5-bromanyl-1H-indol-3-yl)-2-[(2-bromophenyl)carbonylamino]propanoic acid Openeye Name: (2S)-2-[(2-bromobenzoyl)amino]-3-(5-bromo-1H-indol-3-yl)propanoic acid CAS Name: (2S)-3-(5-bromo-1H-indol-3-yl)-2-[[(2-bromophenyl)-oxomethyl]amino]propanoic acid IUPAC Name: (2S)-2-[(2-bromobenzoyl)amino]-3-(5-bromo-1H-indol-3-yl)propanoic acid Traditional Name: (2S)-2-[(2-bromobenzoyl)amino]-3-(5-bromo-1H-indol-3-yl)propionic acid Formula: C18H14Br2N2O3 MolecularWeight: 466.12336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC(CC2=CNC3=C2C=C(C=C3)Br)C(=O)O)Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)N[C@@H](CC2=CNC3=C2C=C(C=C3)Br)C(=O)O)Br

InChI

InChI=1S/C18H14Br2N2O3/c19-11-5-6-15-13(8-11)10(9-21-15)7-16(18(24)25)22-17(23)12-3-1-2-4-14(12)20/h1-6,8-9,16,21H,7H2,(H,22,23)(H,24,25)/t16-/m0/s1