3-[(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)amino]propanoic acid

Systemtic Name: 3-[(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)amino]propanoic acid Openeye Name: 3-[(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)amino]propanoic acid CAS Name: 3-[(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)amino]propanoic acid IUPAC Name: 3-[(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)amino]propanoic acid Traditional Name: 3-[(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)amino]propionic acid Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC(=C(C=C2C(=N1)NCCC(=O)O)OC)OC)C

Isomeric SMILES

CC1(CC2=CC(=C(C=C2C(=N1)NCCC(=O)O)OC)OC)C

InChI

InChI=1S/C16H22N2O4/c1-16(2)9-10-7-12(21-3)13(22-4)8-11(10)15(18-16)17-6-5-14(19)20/h7-8H,5-6,9H2,1-4H3,(H,17,18)(H,19,20)