[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 3-methyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 3-methyl-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-(allylcarbamoylamino)-2-oxo-ethyl] 3-methyl-2-phenyl-quinoline-4-carboxylate CAS Name: 3-methyl-2-phenyl-4-quinolinecarboxylic acid [2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylcarbamoylamino)ethyl] 3-methyl-2-phenylquinoline-4-carboxylate Traditional Name: 3-methyl-2-phenyl-cinchoninic acid [2-(allylcarbamoylamino)-2-keto-ethyl] ester Formula: C23H21N3O4 MolecularWeight: 403.43054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N=C1C3=CC=CC=C3)C(=O)OCC(=O)NC(=O)NCC=C

Isomeric SMILES

CC1=C(C2=CC=CC=C2N=C1C3=CC=CC=C3)C(=O)OCC(=O)NC(=O)NCC=C

InChI

InChI=1S/C23H21N3O4/c1-3-13-24-23(29)26-19(27)14-30-22(28)20-15(2)21(16-9-5-4-6-10-16)25-18-12-8-7-11-17(18)20/h3-12H,1,13-14H2,2H3,(H2,24,26,27,29)