(Z)-but-2-enedioic acid; 3-[2-dimethylaminoethyloxy-(2-methylphenyl)methyl]phenol

Systemtic Name: (Z)-but-2-enedioic acid; 3-[2-dimethylaminoethyloxy-(2-methylphenyl)methyl]phenol Openeye Name: 3-[2-dimethylaminoethyloxy(o-tolyl)methyl]phenol; maleic acid CAS Name: (Z)-2-butenedioic acid; 3-[2-dimethylaminoethyloxy-(2-methylphenyl)methyl]phenol IUPAC Name: (Z)-but-2-enedioic acid; 3-[2-dimethylaminoethyloxy-(2-methylphenyl)methyl]phenol Traditional Name: 3-[2-dimethylaminoethyloxy(o-tolyl)methyl]phenol; maleic acid Formula: C22H27NO6 MolecularWeight: 401.45288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C2=CC(=CC=C2)O)OCCN(C)C.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C(C2=CC(=CC=C2)O)OCCN(C)C.C(=C\C(=O)O)\C(=O)O

InChI

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