ethyl 1-[(2-fluorophenyl)methyl]-4-[3-oxidanyl-1-oxidanylidene-3-(2H-1,2,3,4-tetrazol-5-yl)prop-1-en-2-yl]pyrrole-2-carboxylate

Systemtic Name: ethyl 1-[(2-fluorophenyl)methyl]-4-[3-oxidanyl-1-oxidanylidene-3-(2H-1,2,3,4-tetrazol-5-yl)prop-1-en-2-yl]pyrrole-2-carboxylate Openeye Name: ethyl 1-[(2-fluorophenyl)methyl]-4-[1-[hydroxy(2H-tetrazol-5-yl)methyl]-2-oxo-vinyl]pyrrole-2-carboxylate CAS Name: 1-[(2-fluorophenyl)methyl]-4-[3-hydroxy-1-oxo-3-(2H-tetrazol-5-yl)prop-1-en-2-yl]-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2-fluorophenyl)methyl]-4-[3-hydroxy-1-oxo-3-(2H-tetrazol-5-yl)prop-1-en-2-yl]pyrrole-2-carboxylate Traditional Name: 1-(2-fluorobenzyl)-4-[1-[hydroxy(2H-tetrazol-5-yl)methyl]-2-keto-vinyl]pyrrole-2-carboxylic acid ethyl ester Formula: C18H16FN5O4 MolecularWeight: 385.349143

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CN1CC2=CC=CC=C2F)C(=C=O)C(C3=NNN=N3)O

Isomeric SMILES

CCOC(=O)C1=CC(=CN1CC2=CC=CC=C2F)C(=C=O)C(C3=NNN=N3)O

InChI

InChI=1S/C18H16FN5O4/c1-2-28-18(27)15-7-12(13(10-25)16(26)17-20-22-23-21-17)9-24(15)8-11-5-3-4-6-14(11)19/h3-7,9,16,26H,2,8H2,1H3,(H,20,21,22,23)