methyl 1-(aminocarbonylamino)-2-methyl-4-(phenylmethoxycarbonylamino)pyrrole-3-carboxylate

Systemtic Name: methyl 1-(aminocarbonylamino)-2-methyl-4-(phenylmethoxycarbonylamino)pyrrole-3-carboxylate Openeye Name: methyl 4-(benzyloxycarbonylamino)-2-methyl-1-ureido-pyrrole-3-carboxylate CAS Name: 1-(carbamoylamino)-2-methyl-4-(phenylmethoxycarbonylamino)-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-(carbamoylamino)-2-methyl-4-(phenylmethoxycarbonylamino)pyrrole-3-carboxylate Traditional Name: 4-(benzyloxycarbonylamino)-2-methyl-1-ureido-pyrrole-3-carboxylic acid methyl ester Formula: C16H18N4O5 MolecularWeight: 346.33792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CN1NC(=O)N)NC(=O)OCC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=C(C(=CN1NC(=O)N)NC(=O)OCC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C16H18N4O5/c1-10-13(14(21)24-2)12(8-20(10)19-15(17)22)18-16(23)25-9-11-6-4-3-5-7-11/h3-8H,9H2,1-2H3,(H,18,23)(H3,17,19,22)