methyl 4-[[3-(6-propan-2-ylquinolin-8-yl)phenoxy]methyl]benzoate

Systemtic Name: methyl 4-[[3-(6-propan-2-ylquinolin-8-yl)phenoxy]methyl]benzoate Openeye Name: methyl 4-[[3-(6-isopropyl-8-quinolyl)phenoxy]methyl]benzoate CAS Name: 4-[[3-(6-propan-2-yl-8-quinolinyl)phenoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(6-propan-2-ylquinolin-8-yl)phenoxy]methyl]benzoate Traditional Name: 4-[[3-(6-isopropyl-8-quinolyl)phenoxy]methyl]benzoic acid methyl ester Formula: C27H25NO3 MolecularWeight: 411.4923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)OCC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC(C)C1=CC(=C2C(=C1)C=CC=N2)C3=CC(=CC=C3)OCC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C27H25NO3/c1-18(2)23-14-22-7-5-13-28-26(22)25(16-23)21-6-4-8-24(15-21)31-17-19-9-11-20(12-10-19)27(29)30-3/h4-16,18H,17H2,1-3H3