(Z)-but-2-enedioic acid; 2-methyl-4-(4-methylphenyl)-3,4-dihydro-1H-isoquinolin-8-amine

Systemtic Name: (Z)-but-2-enedioic acid; 2-methyl-4-(4-methylphenyl)-3,4-dihydro-1H-isoquinolin-8-amine Openeye Name: maleic acid; 2-methyl-4-(p-tolyl)-3,4-dihydro-1H-isoquinolin-8-amine CAS Name: (Z)-2-butenedioic acid; 2-methyl-4-(4-methylphenyl)-3,4-dihydro-1H-isoquinolin-8-amine IUPAC Name: (Z)-but-2-enedioic acid; 2-methyl-4-(4-methylphenyl)-3,4-dihydro-1H-isoquinolin-8-amine Traditional Name: maleic acid; [2-methyl-4-(p-tolyl)-3,4-dihydro-1H-isoquinolin-8-yl]amine Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CN(CC3=C2C=CC=C3N)C.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2CN(CC3=C2C=CC=C3N)C.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C17H20N2.C4H4O4/c1-12-6-8-13(9-7-12)15-10-19(2)11-16-14(15)4-3-5-17(16)18;5-3(6)1-2-4(7)8/h3-9,15H,10-11,18H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-