(2S)-2-[[(1S)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]carbonylamino]propanoate

Systemtic Name: (2S)-2-[[(1S)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]carbonylamino]propanoate Openeye Name: (2S)-2-[[(1S)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carbonyl]amino]propanoate CAS Name: (2S)-2-[[[(1S)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]-oxomethyl]amino]propanoate IUPAC Name: (2S)-2-[[(1S)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carbonyl]amino]propanoate Traditional Name: (2S)-2-[[(1S)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carbonyl]amino]propionate Formula: C21H23N2O5- MolecularWeight: 383.41772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])NC(=O)N1CCC2=CC(=C(C=C2C1C3=CC=CC=C3)OC)OC

Isomeric SMILES

C[C@@H](C(=O)[O-])NC(=O)N1CCC2=CC(=C(C=C2[C@@H]1C3=CC=CC=C3)OC)OC

InChI

InChI=1S/C21H24N2O5/c1-13(20(24)25)22-21(26)23-10-9-15-11-17(27-2)18(28-3)12-16(15)19(23)14-7-5-4-6-8-14/h4-8,11-13,19H,9-10H2,1-3H3,(H,22,26)(H,24,25)/p-1/t13-,19-/m0/s1