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

Systemtic Name: (Z)-but-2-enedioic acid; (4R)-2-methyl-4-phenyl-3,4-dihydro-1H-isoquinolin-8-amine Openeye Name: maleic acid; (4R)-2-methyl-4-phenyl-3,4-dihydro-1H-isoquinolin-8-amine CAS Name: (Z)-2-butenedioic acid; (4R)-2-methyl-4-phenyl-3,4-dihydro-1H-isoquinolin-8-amine IUPAC Name: (Z)-but-2-enedioic acid; (4R)-2-methyl-4-phenyl-3,4-dihydro-1H-isoquinolin-8-amine Traditional Name: maleic acid; [(4R)-2-methyl-4-phenyl-3,4-dihydro-1H-isoquinolin-8-yl]amine Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(C2=C(C1)C(=CC=C2)N)C3=CC=CC=C3.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CN1C[C@@H](C2=C(C1)C(=CC=C2)N)C3=CC=CC=C3.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C16H18N2.C4H4O4/c1-18-10-14(12-6-3-2-4-7-12)13-8-5-9-16(17)15(13)11-18;5-3(6)1-2-4(7)8/h2-9,14H,10-11,17H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t14-;/m1./s1