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

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

COC1=C(C=C2C(N(CCC2=C1)C(=O)NCCC(=O)[O-])C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C2[C@H](N(CCC2=C1)C(=O)NCCC(=O)[O-])C3=CC=CC=C3)OC

InChI

InChI=1S/C21H24N2O5/c1-27-17-12-15-9-11-23(21(26)22-10-8-19(24)25)20(14-6-4-3-5-7-14)16(15)13-18(17)28-2/h3-7,12-13,20H,8-11H2,1-2H3,(H,22,26)(H,24,25)/p-1/t20-/m1/s1