[2,3,5-trimethyl-4-oxidanyl-6-(quinolin-2-ylmethyl)phenyl] benzoate

Systemtic Name: [2,3,5-trimethyl-4-oxidanyl-6-(quinolin-2-ylmethyl)phenyl] benzoate Openeye Name: [4-hydroxy-2,3,5-trimethyl-6-(2-quinolylmethyl)phenyl] benzoate CAS Name: benzoic acid [4-hydroxy-2,3,5-trimethyl-6-(2-quinolinylmethyl)phenyl] ester IUPAC Name: [4-hydroxy-2,3,5-trimethyl-6-(quinolin-2-ylmethyl)phenyl] benzoate Traditional Name: benzoic acid [4-hydroxy-2,3,5-trimethyl-6-(2-quinolylmethyl)phenyl] ester Formula: C26H23NO3 MolecularWeight: 397.46572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1O)C)CC2=NC3=CC=CC=C3C=C2)OC(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=C(C(=C1O)C)CC2=NC3=CC=CC=C3C=C2)OC(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C26H23NO3/c1-16-17(2)25(30-26(29)20-10-5-4-6-11-20)22(18(3)24(16)28)15-21-14-13-19-9-7-8-12-23(19)27-21/h4-14,28H,15H2,1-3H3