methyl 3-[2-[3-[(1-ethyl-3-methyl-2-oxidanylidene-quinoxalin-6-yl)carbonylamino]phenyl]ethynyl]benzoate

Systemtic Name: methyl 3-[2-[3-[(1-ethyl-3-methyl-2-oxidanylidene-quinoxalin-6-yl)carbonylamino]phenyl]ethynyl]benzoate Openeye Name: methyl 3-[2-[3-[(1-ethyl-3-methyl-2-oxo-quinoxaline-6-carbonyl)amino]phenyl]ethynyl]benzoate CAS Name: 3-[2-[3-[[(1-ethyl-3-methyl-2-oxo-6-quinoxalinyl)-oxomethyl]amino]phenyl]ethynyl]benzoic acid methyl ester IUPAC Name: methyl 3-[2-[3-[(1-ethyl-3-methyl-2-oxoquinoxaline-6-carbonyl)amino]phenyl]ethynyl]benzoate Traditional Name: 3-[2-[3-[(1-ethyl-2-keto-3-methyl-quinoxaline-6-carbonyl)amino]phenyl]ethynyl]benzoic acid methyl ester Formula: C28H23N3O4 MolecularWeight: 465.49992

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)NC3=CC=CC(=C3)C#CC4=CC(=CC=C4)C(=O)OC)N=C(C1=O)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)NC3=CC=CC(=C3)C#CC4=CC(=CC=C4)C(=O)OC)N=C(C1=O)C

InChI

InChI=1S/C28H23N3O4/c1-4-31-25-14-13-21(17-24(25)29-18(2)27(31)33)26(32)30-23-10-6-8-20(16-23)12-11-19-7-5-9-22(15-19)28(34)35-3/h5-10,13-17H,4H2,1-3H3,(H,30,32)