methyl 4-azanyl-5-oxidanylidene-1-(phenylmethyl)-2H-pyrrole-3-carboxylate

Systemtic Name: methyl 4-azanyl-5-oxidanylidene-1-(phenylmethyl)-2H-pyrrole-3-carboxylate Openeye Name: methyl 4-amino-1-benzyl-5-oxo-2H-pyrrole-3-carboxylate CAS Name: 4-amino-5-oxo-1-(phenylmethyl)-2H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 4-amino-1-benzyl-5-oxo-2H-pyrrole-3-carboxylate Traditional Name: 4-amino-1-benzyl-5-keto-3-pyrroline-3-carboxylic acid methyl ester Formula: C13H14N2O3 MolecularWeight: 246.26186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=O)N(C1)CC2=CC=CC=C2)N

Isomeric SMILES

COC(=O)C1=C(C(=O)N(C1)CC2=CC=CC=C2)N

InChI

InChI=1S/C13H14N2O3/c1-18-13(17)10-8-15(12(16)11(10)14)7-9-5-3-2-4-6-9/h2-6H,7-8,14H2,1H3