N'-[(2S)-2-(2,3-dimethylphenoxy)propanoyl]-2-oxidanylidene-1H-quinoline-4-carbohydrazide

Systemtic Name: N'-[(2S)-2-(2,3-dimethylphenoxy)propanoyl]-2-oxidanylidene-1H-quinoline-4-carbohydrazide Openeye Name: N'-[(2S)-2-(2,3-dimethylphenoxy)propanoyl]-2-oxo-1H-quinoline-4-carbohydrazide CAS Name: N'-[(2S)-2-(2,3-dimethylphenoxy)-1-oxopropyl]-2-oxo-1H-quinoline-4-carbohydrazide IUPAC Name: N'-[(2S)-2-(2,3-dimethylphenoxy)propanoyl]-2-oxo-1H-quinoline-4-carbohydrazide Traditional Name: N'-[(2S)-2-(2,3-dimethylphenoxy)propanoyl]-2-keto-1H-quinoline-4-carbohydrazide Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OC(C)C(=O)NNC(=O)C2=CC(=O)NC3=CC=CC=C32)C

Isomeric SMILES

CC1=C(C(=CC=C1)O[C@@H](C)C(=O)NNC(=O)C2=CC(=O)NC3=CC=CC=C32)C

InChI

InChI=1S/C21H21N3O4/c1-12-7-6-10-18(13(12)2)28-14(3)20(26)23-24-21(27)16-11-19(25)22-17-9-5-4-8-15(16)17/h4-11,14H,1-3H3,(H,22,25)(H,23,26)(H,24,27)/t14-/m0/s1