ethyl 2-azanyl-4-methyl-1-[(4-methylphenyl)carbonylamino]pyrrole-3-carboxylate

Systemtic Name: ethyl 2-azanyl-4-methyl-1-[(4-methylphenyl)carbonylamino]pyrrole-3-carboxylate Openeye Name: ethyl 2-amino-4-methyl-1-[(4-methylbenzoyl)amino]pyrrole-3-carboxylate CAS Name: 2-amino-4-methyl-1-[[(4-methylphenyl)-oxomethyl]amino]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-methyl-1-[(4-methylbenzoyl)amino]pyrrole-3-carboxylate Traditional Name: 2-amino-4-methyl-1-(p-toluoylamino)pyrrole-3-carboxylic acid ethyl ester Formula: C16H19N3O3 MolecularWeight: 301.34036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C=C1C)NC(=O)C2=CC=C(C=C2)C)N

Isomeric SMILES

CCOC(=O)C1=C(N(C=C1C)NC(=O)C2=CC=C(C=C2)C)N

InChI

InChI=1S/C16H19N3O3/c1-4-22-16(21)13-11(3)9-19(14(13)17)18-15(20)12-7-5-10(2)6-8-12/h5-9H,4,17H2,1-3H3,(H,18,20)