2-azanyl-3-[3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]propanoic acid Openeye Name: 2-amino-3-[3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]propanoic acid CAS Name: 2-amino-3-[3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]propanoic acid IUPAC Name: 2-amino-3-[3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]propanoic acid Traditional Name: 2-amino-3-[3-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]propionic acid Formula: C19H22N2O2 MolecularWeight: 310.39018

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC3=CC=CC(=C3)CC(C(=O)O)N

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC3=CC=CC(=C3)CC(C(=O)O)N

InChI

InChI=1S/C19H22N2O2/c20-18(19(22)23)11-14-4-3-5-15(10-14)12-21-9-8-16-6-1-2-7-17(16)13-21/h1-7,10,18H,8-9,11-13,20H2,(H,22,23)