methyl 5-tert-butyl-3-[(3,4-dichlorophenyl)carbamoylamino]-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 5-tert-butyl-3-[(3,4-dichlorophenyl)carbamoylamino]-1H-pyrrole-2-carboxylate Openeye Name: methyl 5-tert-butyl-3-[(3,4-dichlorophenyl)carbamoylamino]-1H-pyrrole-2-carboxylate CAS Name: 5-tert-butyl-3-[[(3,4-dichloroanilino)-oxomethyl]amino]-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 5-tert-butyl-3-[(3,4-dichlorophenyl)carbamoylamino]-1H-pyrrole-2-carboxylate Traditional Name: 5-tert-butyl-3-[(3,4-dichlorophenyl)carbamoylamino]-1H-pyrrole-2-carboxylic acid methyl ester Formula: C17H19Cl2N3O3 MolecularWeight: 384.25706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(N1)C(=O)OC)NC(=O)NC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C)(C)C1=CC(=C(N1)C(=O)OC)NC(=O)NC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C17H19Cl2N3O3/c1-17(2,3)13-8-12(14(22-13)15(23)25-4)21-16(24)20-9-5-6-10(18)11(19)7-9/h5-8,22H,1-4H3,(H2,20,21,24)