N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-2-(4-oxidanylidenecinnolin-1-yl)ethanamide

Systemtic Name: N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-2-(4-oxidanylidenecinnolin-1-yl)ethanamide Openeye Name: N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-2-(4-oxocinnolin-1-yl)acetamide CAS Name: N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-2-(4-oxo-1-cinnolinyl)acetamide IUPAC Name: N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-2-(4-oxocinnolin-1-yl)acetamide Traditional Name: N-[(1S)-1-(3,4-diethoxyphenyl)ethyl]-2-(4-ketocinnolin-1-yl)acetamide Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)NC(=O)CN2C3=CC=CC=C3C(=O)C=N2)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[C@H](C)NC(=O)CN2C3=CC=CC=C3C(=O)C=N2)OCC

InChI

InChI=1S/C22H25N3O4/c1-4-28-20-11-10-16(12-21(20)29-5-2)15(3)24-22(27)14-25-18-9-7-6-8-17(18)19(26)13-23-25/h6-13,15H,4-5,14H2,1-3H3,(H,24,27)/t15-/m0/s1