ethyl 4-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl-prop-2-enyl-amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl-prop-2-enyl-amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[allyl-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]amino]-4-oxo-butanoate CAS Name: 4-[[1-[(4-fluorophenyl)methyl]-2-pyrrolyl]methyl-prop-2-enylamino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl-prop-2-enylamino]-4-oxobutanoate Traditional Name: 4-[allyl-[[1-(4-fluorobenzyl)pyrrol-2-yl]methyl]amino]-4-keto-butyric acid ethyl ester Formula: C21H25FN2O3 MolecularWeight: 372.433203

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)N(CC=C)CC1=CC=CN1CC2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=O)CCC(=O)N(CC=C)CC1=CC=CN1CC2=CC=C(C=C2)F

InChI

InChI=1S/C21H25FN2O3/c1-3-13-24(20(25)11-12-21(26)27-4-2)16-19-6-5-14-23(19)15-17-7-9-18(22)10-8-17/h3,5-10,14H,1,4,11-13,15-16H2,2H3