ethyl 2-[4-[3-(aminomethyl)-4-oxidanyl-phenyl]carbonyl-2,3-dimethyl-phenoxy]ethanoate

Systemtic Name: ethyl 2-[4-[3-(aminomethyl)-4-oxidanyl-phenyl]carbonyl-2,3-dimethyl-phenoxy]ethanoate Openeye Name: ethyl 2-[4-[3-(aminomethyl)-4-hydroxy-benzoyl]-2,3-dimethyl-phenoxy]acetate CAS Name: 2-[4-[[3-(aminomethyl)-4-hydroxyphenyl]-oxomethyl]-2,3-dimethylphenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[3-(aminomethyl)-4-hydroxybenzoyl]-2,3-dimethylphenoxy]acetate Traditional Name: 2-[4-[3-(aminomethyl)-4-hydroxy-benzoyl]-2,3-dimethyl-phenoxy]acetic acid ethyl ester Formula: C20H23NO5 MolecularWeight: 357.40032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=C(C(=C(C=C1)C(=O)C2=CC(=C(C=C2)O)CN)C)C

Isomeric SMILES

CCOC(=O)COC1=C(C(=C(C=C1)C(=O)C2=CC(=C(C=C2)O)CN)C)C

InChI

InChI=1S/C20H23NO5/c1-4-25-19(23)11-26-18-8-6-16(12(2)13(18)3)20(24)14-5-7-17(22)15(9-14)10-21/h5-9,22H,4,10-11,21H2,1-3H3