(Z)-but-2-enedioate; 4-(4-fluorophenyl)-3-methyl-isoquinolin-8-amine

Systemtic Name: (Z)-but-2-enedioate; 4-(4-fluorophenyl)-3-methyl-isoquinolin-8-amine Openeye Name: (Z)-but-2-enedioate; 4-(4-fluorophenyl)-3-methyl-isoquinolin-8-amine CAS Name: (Z)-2-butenedioate; 4-(4-fluorophenyl)-3-methyl-8-isoquinolinamine IUPAC Name: (Z)-but-2-enedioate; 4-(4-fluorophenyl)-3-methylisoquinolin-8-amine Traditional Name: [4-(4-fluorophenyl)-3-methyl-8-isoquinolyl]amine maleate Formula: C20H15FN2O4-2 MolecularWeight: 366.342503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C2C(=C1C3=CC=C(C=C3)F)C=CC=C2N.C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=NC=C2C(=C1C3=CC=C(C=C3)F)C=CC=C2N.C(=C\C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/C16H13FN2.C4H4O4/c1-10-16(11-5-7-12(17)8-6-11)13-3-2-4-15(18)14(13)9-19-10;5-3(6)1-2-4(7)8/h2-9H,18H2,1H3;1-2H,(H,5,6)(H,7,8)/p-2/b;2-1-