methyl 1-(aminocarbonylamino)-4-cyano-2-methyl-5-oxidanylidene-4-phenyl-pyrrole-3-carboxylate

Systemtic Name: methyl 1-(aminocarbonylamino)-4-cyano-2-methyl-5-oxidanylidene-4-phenyl-pyrrole-3-carboxylate Openeye Name: methyl 4-cyano-2-methyl-5-oxo-4-phenyl-1-ureido-pyrrole-3-carboxylate CAS Name: 1-(carbamoylamino)-4-cyano-2-methyl-5-oxo-4-phenyl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-(carbamoylamino)-4-cyano-2-methyl-5-oxo-4-phenylpyrrole-3-carboxylate Traditional Name: 4-cyano-5-keto-2-methyl-4-phenyl-1-ureido-2-pyrroline-3-carboxylic acid methyl ester Formula: C15H14N4O4 MolecularWeight: 314.29606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=O)N1NC(=O)N)(C#N)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=C(C(C(=O)N1NC(=O)N)(C#N)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C15H14N4O4/c1-9-11(12(20)23-2)15(8-16,10-6-4-3-5-7-10)13(21)19(9)18-14(17)22/h3-7H,1-2H3,(H3,17,18,22)