2-[2-(3-butylisoquinolin-1-yl)oxyethyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[2-(3-butylisoquinolin-1-yl)oxyethyl-methyl-amino]ethanoic acid Openeye Name: 2-[2-[(3-butyl-1-isoquinolyl)oxy]ethyl-methyl-amino]acetic acid CAS Name: 2-[2-[(3-butyl-1-isoquinolinyl)oxy]ethyl-methylamino]acetic acid IUPAC Name: 2-[2-(3-butylisoquinolin-1-yl)oxyethyl-methylamino]acetic acid Traditional Name: 2-[2-[(3-butyl-1-isoquinolyl)oxy]ethyl-methyl-amino]acetic acid Formula: C18H24N2O3 MolecularWeight: 316.39476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=CC=CC=C2C(=N1)OCCN(C)CC(=O)O

Isomeric SMILES

CCCCC1=CC2=CC=CC=C2C(=N1)OCCN(C)CC(=O)O

InChI

InChI=1S/C18H24N2O3/c1-3-4-8-15-12-14-7-5-6-9-16(14)18(19-15)23-11-10-20(2)13-17(21)22/h5-7,9,12H,3-4,8,10-11,13H2,1-2H3,(H,21,22)