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

Systemtic Name: methyl 2-cyclopentyl-2-[2-prop-2-enyl-4-(quinolin-2-ylmethoxy)phenyl]ethanoate Openeye Name: methyl 2-[2-allyl-4-(2-quinolylmethoxy)phenyl]-2-cyclopentyl-acetate CAS Name: 2-cyclopentyl-2-[2-prop-2-enyl-4-(2-quinolinylmethoxy)phenyl]acetic acid methyl ester IUPAC Name: methyl 2-cyclopentyl-2-[2-prop-2-enyl-4-(quinolin-2-ylmethoxy)phenyl]acetate Traditional Name: 2-[2-allyl-4-(2-quinolylmethoxy)phenyl]-2-cyclopentyl-acetic acid methyl ester Formula: C27H29NO3 MolecularWeight: 415.52406

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1CCCC1)C2=C(C=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)CC=C

Isomeric SMILES

COC(=O)C(C1CCCC1)C2=C(C=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)CC=C

InChI

InChI=1S/C27H29NO3/c1-3-8-21-17-23(31-18-22-14-13-19-9-6-7-12-25(19)28-22)15-16-24(21)26(27(29)30-2)20-10-4-5-11-20/h3,6-7,9,12-17,20,26H,1,4-5,8,10-11,18H2,2H3