(phenylmethyl) 2-[1-(1-bromanylnaphthalen-2-yl)ethyl]-3-oxidanylidene-butanoate

Systemtic Name: (phenylmethyl) 2-[1-(1-bromanylnaphthalen-2-yl)ethyl]-3-oxidanylidene-butanoate Openeye Name: benzyl 2-acetyl-3-(1-bromo-2-naphthyl)butanoate CAS Name: 2-acetyl-3-(1-bromo-2-naphthalenyl)butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-acetyl-3-(1-bromonaphthalen-2-yl)butanoate Traditional Name: 2-acetyl-3-(1-bromo-2-naphthyl)butyric acid benzyl ester Formula: C23H21BrO3 MolecularWeight: 425.31504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C2=CC=CC=C2C=C1)Br)C(C(=O)C)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C1=C(C2=CC=CC=C2C=C1)Br)C(C(=O)C)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H21BrO3/c1-15(19-13-12-18-10-6-7-11-20(18)22(19)24)21(16(2)25)23(26)27-14-17-8-4-3-5-9-17/h3-13,15,21H,14H2,1-2H3