Source: Brenda (C. Rea)^Converter: smi2mol (Daylight 4.6) SMI2MOL O=CC=O 4 3 0 0 0 0 1 V2000 -1.5300 1.5300 0.0000 O 0 0 0 0 0 0 -0.5100 1.5300 0.0000 C 0 0 0 0 0 0 0.5100 1.5300 0.0000 C 0 0 0 0 0 0 1.5300 1.5300 0.0000 O 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 M END