(2S)-2-(3-chloranylphenoxy)-N-[(1,3-dimethylpyrazol-4-yl)methyl]propanamide

Systemtic Name: (2S)-2-(3-chloranylphenoxy)-N-[(1,3-dimethylpyrazol-4-yl)methyl]propanamide Openeye Name: (2S)-2-(3-chlorophenoxy)-N-[(1,3-dimethylpyrazol-4-yl)methyl]propanamide CAS Name: (2S)-2-(3-chlorophenoxy)-N-[(1,3-dimethyl-4-pyrazolyl)methyl]propanamide IUPAC Name: (2S)-2-(3-chlorophenoxy)-N-[(1,3-dimethylpyrazol-4-yl)methyl]propanamide Traditional Name: (2S)-2-(3-chlorophenoxy)-N-[(1,3-dimethylpyrazol-4-yl)methyl]propionamide Formula: C15H18ClN3O2 MolecularWeight: 307.77532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1CNC(=O)C(C)OC2=CC(=CC=C2)Cl)C

Isomeric SMILES

CC1=NN(C=C1CNC(=O)[C@H](C)OC2=CC(=CC=C2)Cl)C

InChI

InChI=1S/C15H18ClN3O2/c1-10-12(9-19(3)18-10)8-17-15(20)11(2)21-14-6-4-5-13(16)7-14/h4-7,9,11H,8H2,1-3H3,(H,17,20)/t11-/m0/s1