(6-bromanylnaphthalen-2-yl) (3R)-3-acetamido-3-phenyl-propanoate

Systemtic Name: (6-bromanylnaphthalen-2-yl) (3R)-3-acetamido-3-phenyl-propanoate Openeye Name: (6-bromo-2-naphthyl) (3R)-3-acetamido-3-phenyl-propanoate CAS Name: (3R)-3-acetamido-3-phenylpropanoic acid (6-bromo-2-naphthalenyl) ester IUPAC Name: (6-bromonaphthalen-2-yl) (3R)-3-acetamido-3-phenylpropanoate Traditional Name: (3R)-3-acetamido-3-phenyl-propionic acid (6-bromo-2-naphthyl) ester Formula: C21H18BrNO3 MolecularWeight: 412.27652

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)OC1=CC2=C(C=C1)C=C(C=C2)Br)C3=CC=CC=C3

Isomeric SMILES

CC(=O)N[C@H](CC(=O)OC1=CC2=C(C=C1)C=C(C=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C21H18BrNO3/c1-14(24)23-20(15-5-3-2-4-6-15)13-21(25)26-19-10-8-16-11-18(22)9-7-17(16)12-19/h2-12,20H,13H2,1H3,(H,23,24)/t20-/m1/s1