methyl 6-butyl-4-oxidanylidene-7-(1-phenoxyethoxy)-1H-quinoline-3-carboxylate

Systemtic Name: methyl 6-butyl-4-oxidanylidene-7-(1-phenoxyethoxy)-1H-quinoline-3-carboxylate Openeye Name: methyl 6-butyl-4-oxo-7-(1-phenoxyethoxy)-1H-quinoline-3-carboxylate CAS Name: 6-butyl-4-oxo-7-(1-phenoxyethoxy)-1H-quinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 6-butyl-4-oxo-7-(1-phenoxyethoxy)-1H-quinoline-3-carboxylate Traditional Name: 6-butyl-4-keto-7-(1-phenoxyethoxy)-1H-quinoline-3-carboxylic acid methyl ester Formula: C23H25NO5 MolecularWeight: 395.4483

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C2C(=C1)C(=O)C(=CN2)C(=O)OC)OC(C)OC3=CC=CC=C3

Isomeric SMILES

CCCCC1=C(C=C2C(=C1)C(=O)C(=CN2)C(=O)OC)OC(C)OC3=CC=CC=C3

InChI

InChI=1S/C23H25NO5/c1-4-5-9-16-12-18-20(24-14-19(22(18)25)23(26)27-3)13-21(16)29-15(2)28-17-10-7-6-8-11-17/h6-8,10-15H,4-5,9H2,1-3H3,(H,24,25)