(Z)-but-2-enedioate; (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-naphthalen-2-yloxypropanoate

Systemtic Name: (Z)-but-2-enedioate; (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-naphthalen-2-yloxypropanoate Openeye Name: (Z)-but-2-enedioate; (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-(2-naphthyloxy)propanoate CAS Name: (Z)-2-butenedioate; 2-(2-naphthalenyloxy)propanoic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester IUPAC Name: (Z)-but-2-enedioate; (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-naphthalen-2-yloxypropanoate Traditional Name: 2-(2-naphthoxy)propionic acid (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) ester maleate Formula: C25H27NO7-2 MolecularWeight: 453.48438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1CC2CCC(C1)N2C)OC3=CC4=CC=CC=C4C=C3.C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC(C(=O)OC1CC2CCC(C1)N2C)OC3=CC4=CC=CC=C4C=C3.C(=C\C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/C21H25NO3.C4H4O4/c1-14(24-19-10-7-15-5-3-4-6-16(15)11-19)21(23)25-20-12-17-8-9-18(13-20)22(17)2;5-3(6)1-2-4(7)8/h3-7,10-11,14,17-18,20H,8-9,12-13H2,1-2H3;1-2H,(H,5,6)(H,7,8)/p-2/b;2-1-