2-[(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)amino]-4-methyl-pentanoic acid Openeye Name: 2-[(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)amino]-4-methyl-pentanoic acid CAS Name: 2-[(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)amino]-4-methylpentanoic acid IUPAC Name: 2-[(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)amino]-4-methylpentanoic acid Traditional Name: 2-[(6,7-dimethoxy-3,3-dimethyl-4H-isoquinolin-1-yl)amino]-4-methyl-valeric acid Formula: C19H28N2O4 MolecularWeight: 348.43662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC1=NC(CC2=CC(=C(C=C21)OC)OC)(C)C

Isomeric SMILES

CC(C)CC(C(=O)O)NC1=NC(CC2=CC(=C(C=C21)OC)OC)(C)C

InChI

InChI=1S/C19H28N2O4/c1-11(2)7-14(18(22)23)20-17-13-9-16(25-6)15(24-5)8-12(13)10-19(3,4)21-17/h8-9,11,14H,7,10H2,1-6H3,(H,20,21)(H,22,23)