3-(4-oxidanylidenecinnolin-1-yl)-N-[(2S)-2-phenylbutyl]propanamide

Systemtic Name: 3-(4-oxidanylidenecinnolin-1-yl)-N-[(2S)-2-phenylbutyl]propanamide Openeye Name: 3-(4-oxocinnolin-1-yl)-N-[(2S)-2-phenylbutyl]propanamide CAS Name: 3-(4-oxo-1-cinnolinyl)-N-[(2S)-2-phenylbutyl]propanamide IUPAC Name: 3-(4-oxocinnolin-1-yl)-N-[(2S)-2-phenylbutyl]propanamide Traditional Name: 3-(4-ketocinnolin-1-yl)-N-[(2S)-2-phenylbutyl]propionamide Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)CCN1C2=CC=CC=C2C(=O)C=N1)C3=CC=CC=C3

Isomeric SMILES

CC[C@H](CNC(=O)CCN1C2=CC=CC=C2C(=O)C=N1)C3=CC=CC=C3

InChI

InChI=1S/C21H23N3O2/c1-2-16(17-8-4-3-5-9-17)14-22-21(26)12-13-24-19-11-7-6-10-18(19)20(25)15-23-24/h3-11,15-16H,2,12-14H2,1H3,(H,22,26)/t16-/m1/s1