[(2S)-1-[(2-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(4-oxidanylidenecinnolin-1-yl)propanoate

Systemtic Name: [(2S)-1-[(2-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(4-oxidanylidenecinnolin-1-yl)propanoate Openeye Name: [(1S)-2-(2-ethoxyanilino)-1-methyl-2-oxo-ethyl] 3-(4-oxocinnolin-1-yl)propanoate CAS Name: 3-(4-oxo-1-cinnolinyl)propanoic acid [(2S)-1-(2-ethoxyanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2-ethoxyanilino)-1-oxopropan-2-yl] 3-(4-oxocinnolin-1-yl)propanoate Traditional Name: 3-(4-ketocinnolin-1-yl)propionic acid [(1S)-2-keto-1-methyl-2-(o-phenetidino)ethyl] ester Formula: C22H23N3O5 MolecularWeight: 409.43512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C)OC(=O)CCN2C3=CC=CC=C3C(=O)C=N2

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)[C@H](C)OC(=O)CCN2C3=CC=CC=C3C(=O)C=N2

InChI

InChI=1S/C22H23N3O5/c1-3-29-20-11-7-5-9-17(20)24-22(28)15(2)30-21(27)12-13-25-18-10-6-4-8-16(18)19(26)14-23-25/h4-11,14-15H,3,12-13H2,1-2H3,(H,24,28)/t15-/m0/s1