(Z)-but-2-enedioic acid; N,N-dimethyl-2-[(4-methylphenyl)-phenyl-methoxy]ethanamine oxide

Systemtic Name: (Z)-but-2-enedioic acid; N,N-dimethyl-2-[(4-methylphenyl)-phenyl-methoxy]ethanamine oxide Openeye Name: N,N-dimethyl-2-[phenyl(p-tolyl)methoxy]ethanamine oxide; maleic acid CAS Name: (Z)-2-butenedioic acid; N,N-dimethyl-2-[(4-methylphenyl)-phenylmethoxy]ethanamine oxide IUPAC Name: (Z)-but-2-enedioic acid; N,N-dimethyl-2-[(4-methylphenyl)-phenylmethoxy]ethanamine oxide Traditional Name: N,N-dimethyl-2-[phenyl(p-tolyl)methoxy]ethanamine oxide; maleic acid Formula: C22H27NO6 MolecularWeight: 401.45288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CC=C2)OCC[N+](C)(C)[O-].C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CC=C2)OCC[N+](C)(C)[O-].C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C18H23NO2.C4H4O4/c1-15-9-11-17(12-10-15)18(16-7-5-4-6-8-16)21-14-13-19(2,3)20;5-3(6)1-2-4(7)8/h4-12,18H,13-14H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1-