3-(4-methoxyphenyl)-2-[(2-methyl-3,4-dihydro-1H-isoquinolin-3-yl)carbonylamino]propanoic acid

Systemtic Name: 3-(4-methoxyphenyl)-2-[(2-methyl-3,4-dihydro-1H-isoquinolin-3-yl)carbonylamino]propanoic acid Openeye Name: 3-(4-methoxyphenyl)-2-[(2-methyl-3,4-dihydro-1H-isoquinoline-3-carbonyl)amino]propanoic acid CAS Name: 3-(4-methoxyphenyl)-2-[[(2-methyl-3,4-dihydro-1H-isoquinolin-3-yl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-(4-methoxyphenyl)-2-[(2-methyl-3,4-dihydro-1H-isoquinoline-3-carbonyl)amino]propanoic acid Traditional Name: 3-(4-methoxyphenyl)-2-[(2-methyl-3,4-dihydro-1H-isoquinoline-3-carbonyl)amino]propionic acid Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=CC=CC=C2CC1C(=O)NC(CC3=CC=C(C=C3)OC)C(=O)O

Isomeric SMILES

CN1CC2=CC=CC=C2CC1C(=O)NC(CC3=CC=C(C=C3)OC)C(=O)O

InChI

InChI=1S/C21H24N2O4/c1-23-13-16-6-4-3-5-15(16)12-19(23)20(24)22-18(21(25)26)11-14-7-9-17(27-2)10-8-14/h3-10,18-19H,11-13H2,1-2H3,(H,22,24)(H,25,26)