[2-(methylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl] 2,6-dimethylquinoline-4-carboxylate

Systemtic Name: [2-(methylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl] 2,6-dimethylquinoline-4-carboxylate Openeye Name: [2-(methylcarbamoylamino)-2-oxo-1-phenyl-ethyl] 2,6-dimethylquinoline-4-carboxylate CAS Name: 2,6-dimethyl-4-quinolinecarboxylic acid [2-(methylcarbamoylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(methylcarbamoylamino)-2-oxo-1-phenylethyl] 2,6-dimethylquinoline-4-carboxylate Traditional Name: 2,6-dimethylcinchoninic acid [2-keto-2-(methylcarbamoylamino)-1-phenyl-ethyl] ester Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)OC(C3=CC=CC=C3)C(=O)NC(=O)NC)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)OC(C3=CC=CC=C3)C(=O)NC(=O)NC)C

InChI

InChI=1S/C22H21N3O4/c1-13-9-10-18-16(11-13)17(12-14(2)24-18)21(27)29-19(15-7-5-4-6-8-15)20(26)25-22(28)23-3/h4-12,19H,1-3H3,(H2,23,25,26,28)