2-[2-azanyl-5-chloranyl-3-(3,4,5-trimethoxyphenyl)carbonyl-phenyl]ethanoic acid

Systemtic Name: 2-[2-azanyl-5-chloranyl-3-(3,4,5-trimethoxyphenyl)carbonyl-phenyl]ethanoic acid Openeye Name: 2-[2-amino-5-chloro-3-(3,4,5-trimethoxybenzoyl)phenyl]acetic acid CAS Name: 2-[2-amino-5-chloro-3-[oxo-(3,4,5-trimethoxyphenyl)methyl]phenyl]acetic acid IUPAC Name: 2-[2-amino-5-chloro-3-(3,4,5-trimethoxybenzoyl)phenyl]acetic acid Traditional Name: 2-[2-amino-5-chloro-3-(3,4,5-trimethoxybenzoyl)phenyl]acetic acid Formula: C18H18ClNO6 MolecularWeight: 379.79162

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)C2=CC(=CC(=C2N)CC(=O)O)Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)C2=CC(=CC(=C2N)CC(=O)O)Cl

InChI

InChI=1S/C18H18ClNO6/c1-24-13-5-10(6-14(25-2)18(13)26-3)17(23)12-8-11(19)4-9(16(12)20)7-15(21)22/h4-6,8H,7,20H2,1-3H3,(H,21,22)