methyl 2-[3-(butanoylamino)-4-oxidanyl-phenyl]ethanoate

Systemtic Name: methyl 2-[3-(butanoylamino)-4-oxidanyl-phenyl]ethanoate Openeye Name: methyl 2-[3-(butanoylamino)-4-hydroxy-phenyl]acetate CAS Name: 2-[4-hydroxy-3-(1-oxobutylamino)phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-(butanoylamino)-4-hydroxyphenyl]acetate Traditional Name: 2-(3-butyramido-4-hydroxy-phenyl)acetic acid methyl ester Formula: C13H17NO4 MolecularWeight: 251.27838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C=CC(=C1)CC(=O)OC)O

Isomeric SMILES

CCCC(=O)NC1=C(C=CC(=C1)CC(=O)OC)O

InChI

InChI=1S/C13H17NO4/c1-3-4-12(16)14-10-7-9(5-6-11(10)15)8-13(17)18-2/h5-7,15H,3-4,8H2,1-2H3,(H,14,16)