methyl 3-azanyl-1-cyano-4-fluoranyl-1-(1-methylpyrrol-2-yl)indene-2-carboxylate

Systemtic Name: methyl 3-azanyl-1-cyano-4-fluoranyl-1-(1-methylpyrrol-2-yl)indene-2-carboxylate Openeye Name: methyl 3-amino-1-cyano-4-fluoro-1-(1-methylpyrrol-2-yl)indene-2-carboxylate CAS Name: 3-amino-1-cyano-4-fluoro-1-(1-methyl-2-pyrrolyl)-2-indenecarboxylic acid methyl ester IUPAC Name: methyl 3-amino-1-cyano-4-fluoro-1-(1-methylpyrrol-2-yl)indene-2-carboxylate Traditional Name: 3-amino-1-cyano-4-fluoro-1-(1-methylpyrrol-2-yl)indene-2-carboxylic acid methyl ester Formula: C17H14FN3O2 MolecularWeight: 311.310363

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2(C3=C(C(=CC=C3)F)C(=C2C(=O)OC)N)C#N

Isomeric SMILES

CN1C=CC=C1C2(C3=C(C(=CC=C3)F)C(=C2C(=O)OC)N)C#N

InChI

InChI=1S/C17H14FN3O2/c1-21-8-4-7-12(21)17(9-19)10-5-3-6-11(18)13(10)15(20)14(17)16(22)23-2/h3-8H,20H2,1-2H3