methyl 2-cyclopentyl-2-[2-ethyl-4-(quinolin-2-ylmethoxy)phenyl]ethanoate

Systemtic Name: methyl 2-cyclopentyl-2-[2-ethyl-4-(quinolin-2-ylmethoxy)phenyl]ethanoate Openeye Name: methyl 2-cyclopentyl-2-[2-ethyl-4-(2-quinolylmethoxy)phenyl]acetate CAS Name: 2-cyclopentyl-2-[2-ethyl-4-(2-quinolinylmethoxy)phenyl]acetic acid methyl ester IUPAC Name: methyl 2-cyclopentyl-2-[2-ethyl-4-(quinolin-2-ylmethoxy)phenyl]acetate Traditional Name: 2-cyclopentyl-2-[2-ethyl-4-(2-quinolylmethoxy)phenyl]acetic acid methyl ester Formula: C26H29NO3 MolecularWeight: 403.51336

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)OCC2=NC3=CC=CC=C3C=C2)C(C4CCCC4)C(=O)OC

Isomeric SMILES

CCC1=C(C=CC(=C1)OCC2=NC3=CC=CC=C3C=C2)C(C4CCCC4)C(=O)OC

InChI

InChI=1S/C26H29NO3/c1-3-18-16-22(30-17-21-13-12-19-8-6-7-11-24(19)27-21)14-15-23(18)25(26(28)29-2)20-9-4-5-10-20/h6-8,11-16,20,25H,3-5,9-10,17H2,1-2H3