(2S)-2-(4-chloranyl-3,5-dimethyl-phenoxy)-N-(8-propoxyquinolin-5-yl)propanamide

Systemtic Name: (2S)-2-(4-chloranyl-3,5-dimethyl-phenoxy)-N-(8-propoxyquinolin-5-yl)propanamide Openeye Name: (2S)-2-(4-chloro-3,5-dimethyl-phenoxy)-N-(8-propoxy-5-quinolyl)propanamide CAS Name: (2S)-2-(4-chloro-3,5-dimethylphenoxy)-N-(8-propoxy-5-quinolinyl)propanamide IUPAC Name: (2S)-2-(4-chloro-3,5-dimethylphenoxy)-N-(8-propoxyquinolin-5-yl)propanamide Traditional Name: (2S)-2-(4-chloro-3,5-dimethyl-phenoxy)-N-(8-propoxy-5-quinolyl)propionamide Formula: C23H25ClN2O3 MolecularWeight: 412.9092

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C2C(=C(C=C1)NC(=O)C(C)OC3=CC(=C(C(=C3)C)Cl)C)C=CC=N2

Isomeric SMILES

CCCOC1=C2C(=C(C=C1)NC(=O)[C@H](C)OC3=CC(=C(C(=C3)C)Cl)C)C=CC=N2

InChI

InChI=1S/C23H25ClN2O3/c1-5-11-28-20-9-8-19(18-7-6-10-25-22(18)20)26-23(27)16(4)29-17-12-14(2)21(24)15(3)13-17/h6-10,12-13,16H,5,11H2,1-4H3,(H,26,27)/t16-/m0/s1