ethyl 3-(hydroxymethyl)-4-oxidanyl-2,6-diphenyl-5-pyridin-3-yl-benzoate

Systemtic Name: ethyl 3-(hydroxymethyl)-4-oxidanyl-2,6-diphenyl-5-pyridin-3-yl-benzoate Openeye Name: ethyl 4-hydroxy-3-(hydroxymethyl)-2,6-diphenyl-5-(3-pyridyl)benzoate CAS Name: 4-hydroxy-3-(hydroxymethyl)-2,6-diphenyl-5-(3-pyridinyl)benzoic acid ethyl ester IUPAC Name: ethyl 4-hydroxy-3-(hydroxymethyl)-2,6-diphenyl-5-pyridin-3-ylbenzoate Traditional Name: 4-hydroxy-3-methylol-2,6-diphenyl-5-(3-pyridyl)benzoic acid ethyl ester Formula: C27H23NO4 MolecularWeight: 425.47582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(C(=C1C2=CC=CC=C2)C3=CN=CC=C3)O)CO)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(C(=C(C(=C1C2=CC=CC=C2)C3=CN=CC=C3)O)CO)C4=CC=CC=C4

InChI

InChI=1S/C27H23NO4/c1-2-32-27(31)25-22(18-10-5-3-6-11-18)21(17-29)26(30)24(20-14-9-15-28-16-20)23(25)19-12-7-4-8-13-19/h3-16,29-30H,2,17H2,1H3