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

Systemtic Name: ethyl 2-[4-[3-(aminomethyl)-4-oxidanyl-phenyl]carbonyl-3-chloranyl-phenoxy]ethanoate Openeye Name: ethyl 2-[4-[3-(aminomethyl)-4-hydroxy-benzoyl]-3-chloro-phenoxy]acetate CAS Name: 2-[4-[[3-(aminomethyl)-4-hydroxyphenyl]-oxomethyl]-3-chlorophenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[3-(aminomethyl)-4-hydroxybenzoyl]-3-chlorophenoxy]acetate Traditional Name: 2-[4-[3-(aminomethyl)-4-hydroxy-benzoyl]-3-chloro-phenoxy]acetic acid ethyl ester Formula: C18H18ClNO5 MolecularWeight: 363.79222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18ClNO5/c1-2-24-17(22)10-25-13-4-5-14(15(19)8-13)18(23)11-3-6-16(21)12(7-11)9-20/h3-8,21H,2,9-10,20H2,1H3