2-[6-[[3-(aminomethyl)phenyl]methoxy]-1-oxidanylidene-3,4-dihydroisoquinolin-2-yl]ethanoic acid

Systemtic Name: 2-[6-[[3-(aminomethyl)phenyl]methoxy]-1-oxidanylidene-3,4-dihydroisoquinolin-2-yl]ethanoic acid Openeye Name: 2-[6-[[3-(aminomethyl)phenyl]methoxy]-1-oxo-3,4-dihydroisoquinolin-2-yl]acetic acid CAS Name: 2-[6-[[3-(aminomethyl)phenyl]methoxy]-1-oxo-3,4-dihydroisoquinolin-2-yl]acetic acid IUPAC Name: 2-[6-[[3-(aminomethyl)phenyl]methoxy]-1-oxo-3,4-dihydroisoquinolin-2-yl]acetic acid Traditional Name: 2-[6-[3-(aminomethyl)benzyl]oxy-1-keto-3,4-dihydroisoquinolin-2-yl]acetic acid Formula: C19H20N2O4 MolecularWeight: 340.3731

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C2=C1C=C(C=C2)OCC3=CC=CC(=C3)CN)CC(=O)O

Isomeric SMILES

C1CN(C(=O)C2=C1C=C(C=C2)OCC3=CC=CC(=C3)CN)CC(=O)O

InChI

InChI=1S/C19H20N2O4/c20-10-13-2-1-3-14(8-13)12-25-16-4-5-17-15(9-16)6-7-21(19(17)24)11-18(22)23/h1-5,8-9H,6-7,10-12,20H2,(H,22,23)