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

Systemtic Name: 2-azanyl-3-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]phenyl]propanoic acid Openeye Name: 2-amino-3-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]phenyl]propanoic acid CAS Name: 2-amino-3-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]phenyl]propanoic acid IUPAC Name: 2-amino-3-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]phenyl]propanoic acid Traditional Name: 2-amino-3-[3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]phenyl]propionic acid Formula: C24H24N2O2 MolecularWeight: 372.45956

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=CC=CC(=C3)C4=CC(=CC=C4)CC(C(=O)O)N

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=CC=CC(=C3)C4=CC(=CC=C4)CC(C(=O)O)N

InChI

InChI=1S/C24H24N2O2/c25-23(24(27)28)14-17-5-3-8-19(13-17)20-9-4-10-22(15-20)26-12-11-18-6-1-2-7-21(18)16-26/h1-10,13,15,23H,11-12,14,16,25H2,(H,27,28)