2-cycloheptyl-2-[4-(quinolin-2-ylmethoxy)phenyl]ethanoate

Systemtic Name: 2-cycloheptyl-2-[4-(quinolin-2-ylmethoxy)phenyl]ethanoate Openeye Name: 2-cycloheptyl-2-[4-(2-quinolylmethoxy)phenyl]acetate CAS Name: 2-cycloheptyl-2-[4-(2-quinolinylmethoxy)phenyl]acetate IUPAC Name: 2-cycloheptyl-2-[4-(quinolin-2-ylmethoxy)phenyl]acetate Traditional Name: 2-cycloheptyl-2-[4-(2-quinolylmethoxy)phenyl]acetate Formula: C25H26NO3- MolecularWeight: 388.47884

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)C(C2=CC=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)C(=O)[O-]

Isomeric SMILES

C1CCCC(CC1)C(C2=CC=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)C(=O)[O-]

InChI

InChI=1S/C25H27NO3/c27-25(28)24(19-8-3-1-2-4-9-19)20-12-15-22(16-13-20)29-17-21-14-11-18-7-5-6-10-23(18)26-21/h5-7,10-16,19,24H,1-4,8-9,17H2,(H,27,28)/p-1