2-[1-oxidanylidene-6-(piperidin-4-ylmethoxy)-3,4-dihydroisoquinolin-2-yl]ethanoic acid

Systemtic Name: 2-[1-oxidanylidene-6-(piperidin-4-ylmethoxy)-3,4-dihydroisoquinolin-2-yl]ethanoic acid Openeye Name: 2-[1-oxo-6-(4-piperidylmethoxy)-3,4-dihydroisoquinolin-2-yl]acetic acid CAS Name: 2-[1-oxo-6-(4-piperidinylmethoxy)-3,4-dihydroisoquinolin-2-yl]acetic acid IUPAC Name: 2-[1-oxo-6-(piperidin-4-ylmethoxy)-3,4-dihydroisoquinolin-2-yl]acetic acid Traditional Name: 2-[1-keto-6-(4-piperidylmethoxy)-3,4-dihydroisoquinolin-2-yl]acetic acid Formula: C17H22N2O4 MolecularWeight: 318.36758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1COC2=CC3=C(C=C2)C(=O)N(CC3)CC(=O)O

Isomeric SMILES

C1CNCCC1COC2=CC3=C(C=C2)C(=O)N(CC3)CC(=O)O

InChI

InChI=1S/C17H22N2O4/c20-16(21)10-19-8-5-13-9-14(1-2-15(13)17(19)22)23-11-12-3-6-18-7-4-12/h1-2,9,12,18H,3-8,10-11H2,(H,20,21)