(2R)-2-[(6,7-dimethoxy-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)azaniumyl]-4-methyl-pentanoate

Systemtic Name: (2R)-2-[(6,7-dimethoxy-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)azaniumyl]-4-methyl-pentanoate Openeye Name: (2R)-2-[(6,7-dimethoxy-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)ammonio]-4-methyl-pentanoate CAS Name: (2R)-2-[(6,7-dimethoxy-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)ammonio]-4-methylpentanoate IUPAC Name: (2R)-2-[(6,7-dimethoxy-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)azaniumyl]-4-methylpentanoate Traditional Name: (2R)-2-[(6,7-dimethoxy-3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)ammonio]-4-methyl-valerate Formula: C19H28N2O4 MolecularWeight: 348.43662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])[NH+]=C1C2=CC(=C(C=C2CC(N1)(C)C)OC)OC

Isomeric SMILES

CC(C)C[C@H](C(=O)[O-])[NH+]=C1C2=CC(=C(C=C2CC(N1)(C)C)OC)OC

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)/t14-/m1/s1