(2S)-2-[2-(6-bromanylindol-1-yl)ethanoylamino]-3-phenyl-propanoate

Systemtic Name: (2S)-2-[2-(6-bromanylindol-1-yl)ethanoylamino]-3-phenyl-propanoate Openeye Name: (2S)-2-[[2-(6-bromoindol-1-yl)acetyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[2-(6-bromo-1-indolyl)-1-oxoethyl]amino]-3-phenylpropanoate IUPAC Name: (2S)-2-[[2-(6-bromoindol-1-yl)acetyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[2-(6-bromoindol-1-yl)acetyl]amino]-3-phenyl-propionate Formula: C19H16BrN2O3- MolecularWeight: 400.24594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)[O-])NC(=O)CN2C=CC3=C2C=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)[O-])NC(=O)CN2C=CC3=C2C=C(C=C3)Br

InChI

InChI=1S/C19H17BrN2O3/c20-15-7-6-14-8-9-22(17(14)11-15)12-18(23)21-16(19(24)25)10-13-4-2-1-3-5-13/h1-9,11,16H,10,12H2,(H,21,23)(H,24,25)/p-1/t16-/m0/s1