[1-oxidanylidene-1-(phenylcarbamoylamino)propan-2-yl] 2,6-dimethylquinoline-4-carboxylate

Systemtic Name: [1-oxidanylidene-1-(phenylcarbamoylamino)propan-2-yl] 2,6-dimethylquinoline-4-carboxylate Openeye Name: [1-methyl-2-oxo-2-(phenylcarbamoylamino)ethyl] 2,6-dimethylquinoline-4-carboxylate CAS Name: 2,6-dimethyl-4-quinolinecarboxylic acid [1-[[anilino(oxo)methyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-oxo-1-(phenylcarbamoylamino)propan-2-yl] 2,6-dimethylquinoline-4-carboxylate Traditional Name: 2,6-dimethylcinchoninic acid [2-keto-1-methyl-2-(phenylcarbamoylamino)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(C)C(=O)NC(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)OC(C)C(=O)NC(=O)NC3=CC=CC=C3)C

InChI

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