methyl 2-[[1-[(2-fluorophenyl)methyl]pyrrol-2-yl]methyl-prop-2-enyl-amino]ethanoate

Systemtic Name: methyl 2-[[1-[(2-fluorophenyl)methyl]pyrrol-2-yl]methyl-prop-2-enyl-amino]ethanoate Openeye Name: methyl 2-[allyl-[[1-[(2-fluorophenyl)methyl]pyrrol-2-yl]methyl]amino]acetate CAS Name: 2-[[1-[(2-fluorophenyl)methyl]-2-pyrrolyl]methyl-prop-2-enylamino]acetic acid methyl ester IUPAC Name: methyl 2-[[1-[(2-fluorophenyl)methyl]pyrrol-2-yl]methyl-prop-2-enylamino]acetate Traditional Name: 2-[allyl-[[1-(2-fluorobenzyl)pyrrol-2-yl]methyl]amino]acetic acid methyl ester Formula: C18H21FN2O2 MolecularWeight: 316.369943

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN(CC=C)CC1=CC=CN1CC2=CC=CC=C2F

Isomeric SMILES

COC(=O)CN(CC=C)CC1=CC=CN1CC2=CC=CC=C2F

InChI

InChI=1S/C18H21FN2O2/c1-3-10-20(14-18(22)23-2)13-16-8-6-11-21(16)12-15-7-4-5-9-17(15)19/h3-9,11H,1,10,12-14H2,2H3