(Z)-but-2-enedioate; 2-[4-(2-morpholin-4-ylethyl)-2-phenyl-1,3-benzodioxol-2-yl]ethanoate

Systemtic Name: (Z)-but-2-enedioate; 2-[4-(2-morpholin-4-ylethyl)-2-phenyl-1,3-benzodioxol-2-yl]ethanoate Openeye Name: (Z)-but-2-enedioate; 2-[4-(2-morpholinoethyl)-2-phenyl-1,3-benzodioxol-2-yl]acetate CAS Name: (Z)-2-butenedioate; 2-[4-[2-(4-morpholinyl)ethyl]-2-phenyl-1,3-benzodioxol-2-yl]acetate IUPAC Name: (Z)-but-2-enedioate; 2-[4-(2-morpholin-4-ylethyl)-2-phenyl-1,3-benzodioxol-2-yl]acetate Traditional Name: 2-[4-(2-morpholinoethyl)-2-phenyl-1,3-benzodioxol-2-yl]acetate maleate Formula: C25H24NO9-3 MolecularWeight: 482.45936

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCC2=C3C(=CC=C2)OC(O3)(CC(=O)[O-])C4=CC=CC=C4.C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1COCCN1CCC2=C3C(=CC=C2)OC(O3)(CC(=O)[O-])C4=CC=CC=C4.C(=C\C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/C21H23NO5.C4H4O4/c23-19(24)15-21(17-6-2-1-3-7-17)26-18-8-4-5-16(20(18)27-21)9-10-22-11-13-25-14-12-22;5-3(6)1-2-4(7)8/h1-8H,9-15H2,(H,23,24);1-2H,(H,5,6)(H,7,8)/p-3/b;2-1-