methyl 8-phenylmethoxy-4-(3-phenylmethoxyprop-1-ynyl)quinoline-2-carboxylate

Systemtic Name: methyl 8-phenylmethoxy-4-(3-phenylmethoxyprop-1-ynyl)quinoline-2-carboxylate Openeye Name: methyl 8-benzyloxy-4-(3-benzyloxyprop-1-ynyl)quinoline-2-carboxylate CAS Name: 8-phenylmethoxy-4-(3-phenylmethoxyprop-1-ynyl)-2-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 8-phenylmethoxy-4-(3-phenylmethoxyprop-1-ynyl)quinoline-2-carboxylate Traditional Name: 8-benzoxy-4-(3-benzoxyprop-1-ynyl)quinaldic acid methyl ester Formula: C28H23NO4 MolecularWeight: 437.48652

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC2=C(C=CC=C2OCC3=CC=CC=C3)C(=C1)C#CCOCC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=NC2=C(C=CC=C2OCC3=CC=CC=C3)C(=C1)C#CCOCC4=CC=CC=C4

InChI

InChI=1S/C28H23NO4/c1-31-28(30)25-18-23(14-9-17-32-19-21-10-4-2-5-11-21)24-15-8-16-26(27(24)29-25)33-20-22-12-6-3-7-13-22/h2-8,10-13,15-16,18H,17,19-20H2,1H3