methyl 4-[(2-ethylquinolin-4-yl)-oxidanyl-methyl]benzoate

Systemtic Name: methyl 4-[(2-ethylquinolin-4-yl)-oxidanyl-methyl]benzoate Openeye Name: methyl 4-[(2-ethyl-4-quinolyl)-hydroxy-methyl]benzoate CAS Name: 4-[(2-ethyl-4-quinolinyl)-hydroxymethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-ethylquinolin-4-yl)-hydroxymethyl]benzoate Traditional Name: 4-[(2-ethyl-4-quinolyl)-hydroxy-methyl]benzoic acid methyl ester Formula: C20H19NO3 MolecularWeight: 321.36976

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1)C(C3=CC=C(C=C3)C(=O)OC)O

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1)C(C3=CC=C(C=C3)C(=O)OC)O

InChI

InChI=1S/C20H19NO3/c1-3-15-12-17(16-6-4-5-7-18(16)21-15)19(22)13-8-10-14(11-9-13)20(23)24-2/h4-12,19,22H,3H2,1-2H3