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

Systemtic Name: 2-[1-oxidanylidene-6-(3-piperidin-4-ylpropoxy)-3,4-dihydroisoquinolin-2-yl]ethanoic acid Openeye Name: 2-[1-oxo-6-[3-(4-piperidyl)propoxy]-3,4-dihydroisoquinolin-2-yl]acetic acid CAS Name: 2-[1-oxo-6-[3-(4-piperidinyl)propoxy]-3,4-dihydroisoquinolin-2-yl]acetic acid IUPAC Name: 2-[1-oxo-6-(3-piperidin-4-ylpropoxy)-3,4-dihydroisoquinolin-2-yl]acetic acid Traditional Name: 2-[1-keto-6-[3-(4-piperidyl)propoxy]-3,4-dihydroisoquinolin-2-yl]acetic acid Formula: C19H26N2O4 MolecularWeight: 346.42074

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CCCOC2=CC3=C(C=C2)C(=O)N(CC3)CC(=O)O

Isomeric SMILES

C1CNCCC1CCCOC2=CC3=C(C=C2)C(=O)N(CC3)CC(=O)O

InChI

InChI=1S/C19H26N2O4/c22-18(23)13-21-10-7-15-12-16(3-4-17(15)19(21)24)25-11-1-2-14-5-8-20-9-6-14/h3-4,12,14,20H,1-2,5-11,13H2,(H,22,23)