methyl 3-azanyl-4-[(3-fluorophenyl)methyl]-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 3-azanyl-4-[(3-fluorophenyl)methyl]-1H-pyrrole-2-carboxylate Openeye Name: methyl 3-amino-4-[(3-fluorophenyl)methyl]-1H-pyrrole-2-carboxylate CAS Name: 3-amino-4-[(3-fluorophenyl)methyl]-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-amino-4-[(3-fluorophenyl)methyl]-1H-pyrrole-2-carboxylate Traditional Name: 3-amino-4-(3-fluorobenzyl)-1H-pyrrole-2-carboxylic acid methyl ester Formula: C13H13FN2O2 MolecularWeight: 248.252923

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=CN1)CC2=CC(=CC=C2)F)N

Isomeric SMILES

COC(=O)C1=C(C(=CN1)CC2=CC(=CC=C2)F)N

InChI

InChI=1S/C13H13FN2O2/c1-18-13(17)12-11(15)9(7-16-12)5-8-3-2-4-10(14)6-8/h2-4,6-7,16H,5,15H2,1H3