(Z)-but-2-enedioic acid; [2-(phenoxymethyl)phenyl]methanamine

Systemtic Name: (Z)-but-2-enedioic acid; [2-(phenoxymethyl)phenyl]methanamine Openeye Name: maleic acid; [2-(phenoxymethyl)phenyl]methanamine CAS Name: (Z)-2-butenedioic acid; [2-(phenoxymethyl)phenyl]methanamine IUPAC Name: (Z)-but-2-enedioic acid; [2-(phenoxymethyl)phenyl]methanamine Traditional Name: maleic acid; [2-(phenoxymethyl)benzyl]amine Formula: C18H19NO5 MolecularWeight: 329.34716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=CC=CC=C2CN.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OCC2=CC=CC=C2CN.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C14H15NO.C4H4O4/c15-10-12-6-4-5-7-13(12)11-16-14-8-2-1-3-9-14;5-3(6)1-2-4(7)8/h1-9H,10-11,15H2;1-2H,(H,5,6)(H,7,8)/b;2-1-