2-[[3-(aminomethyl)phenyl]carbonyl-(2,3-dihydro-1-benzofuran-5-yl)amino]ethanoic acid

Systemtic Name: 2-[[3-(aminomethyl)phenyl]carbonyl-(2,3-dihydro-1-benzofuran-5-yl)amino]ethanoic acid Openeye Name: 2-[[3-(aminomethyl)benzoyl]-(2,3-dihydrobenzofuran-5-yl)amino]acetic acid CAS Name: 2-[[[3-(aminomethyl)phenyl]-oxomethyl]-(2,3-dihydrobenzofuran-5-yl)amino]acetic acid IUPAC Name: 2-[[3-(aminomethyl)benzoyl]-(2,3-dihydro-1-benzofuran-5-yl)amino]acetic acid Traditional Name: 2-[[3-(aminomethyl)benzoyl]-coumaran-5-yl-amino]acetic acid Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)N(CC(=O)O)C(=O)C3=CC(=CC=C3)CN

Isomeric SMILES

C1COC2=C1C=C(C=C2)N(CC(=O)O)C(=O)C3=CC(=CC=C3)CN

InChI

InChI=1S/C18H18N2O4/c19-10-12-2-1-3-14(8-12)18(23)20(11-17(21)22)15-4-5-16-13(9-15)6-7-24-16/h1-5,8-9H,6-7,10-11,19H2,(H,21,22)