ethyl 1-(aminocarbonylamino)-4-chloranyl-2-(methoxymethyl)-5-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-(aminocarbonylamino)-4-chloranyl-2-(methoxymethyl)-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 4-chloro-2-(methoxymethyl)-5-phenyl-1-ureido-pyrrole-3-carboxylate CAS Name: 1-(carbamoylamino)-4-chloro-2-(methoxymethyl)-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(carbamoylamino)-4-chloro-2-(methoxymethyl)-5-phenylpyrrole-3-carboxylate Traditional Name: 4-chloro-2-(methoxymethyl)-5-phenyl-1-ureido-pyrrole-3-carboxylic acid ethyl ester Formula: C16H18ClN3O4 MolecularWeight: 351.78482

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1Cl)C2=CC=CC=C2)NC(=O)N)COC

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1Cl)C2=CC=CC=C2)NC(=O)N)COC

InChI

InChI=1S/C16H18ClN3O4/c1-3-24-15(21)12-11(9-23-2)20(19-16(18)22)14(13(12)17)10-7-5-4-6-8-10/h4-8H,3,9H2,1-2H3,(H3,18,19,22)