[1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 6-methyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 6-methyl-2-phenyl-quinoline-4-carboxylate Openeye Name: (1-allophanoyl-2-methyl-propyl) 6-methyl-2-phenyl-quinoline-4-carboxylate CAS Name: 6-methyl-2-phenyl-4-quinolinecarboxylic acid [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 6-methyl-2-phenylquinoline-4-carboxylate Traditional Name: 6-methyl-2-phenyl-cinchoninic acid (1-allophanoyl-2-methyl-propyl) ester Formula: C23H23N3O4 MolecularWeight: 405.44642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23N3O4/c1-13(2)20(21(27)26-23(24)29)30-22(28)17-12-19(15-7-5-4-6-8-15)25-18-10-9-14(3)11-16(17)18/h4-13,20H,1-3H3,(H3,24,26,27,29)