(Z)-but-2-enedioic acid; 1-[3-(dimethylamino)-2-methyl-phenyl]propan-1-one

Systemtic Name: (Z)-but-2-enedioic acid; 1-[3-(dimethylamino)-2-methyl-phenyl]propan-1-one Openeye Name: 1-[3-(dimethylamino)-2-methyl-phenyl]propan-1-one; maleic acid CAS Name: (Z)-2-butenedioic acid; 1-[3-(dimethylamino)-2-methylphenyl]-1-propanone IUPAC Name: (Z)-but-2-enedioic acid; 1-[3-(dimethylamino)-2-methylphenyl]propan-1-one Traditional Name: 1-[3-(dimethylamino)-2-methyl-phenyl]propan-1-one; maleic acid Formula: C16H21NO5 MolecularWeight: 307.34164

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C(=CC=C1)N(C)C)C.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCC(=O)C1=C(C(=CC=C1)N(C)C)C.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C12H17NO.C4H4O4/c1-5-12(14)10-7-6-8-11(9(10)2)13(3)4;5-3(6)1-2-4(7)8/h6-8H,5H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b;2-1-