[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoate

Systemtic Name: [2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoate Openeye Name: [2-(isopentylcarbamoylamino)-2-oxo-ethyl] 3-(5-bromo-2-fluoro-phenyl)prop-2-enoate CAS Name: 3-(5-bromo-2-fluorophenyl)-2-propenoic acid [2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylcarbamoylamino)-2-oxoethyl] 3-(5-bromo-2-fluorophenyl)prop-2-enoate Traditional Name: 3-(5-bromo-2-fluoro-phenyl)acrylic acid [2-(isoamylcarbamoylamino)-2-keto-ethyl] ester Formula: C17H20BrFN2O4 MolecularWeight: 415.254103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)COC(=O)C=CC1=C(C=CC(=C1)Br)F

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)COC(=O)C=CC1=C(C=CC(=C1)Br)F

InChI

InChI=1S/C17H20BrFN2O4/c1-11(2)7-8-20-17(24)21-15(22)10-25-16(23)6-3-12-9-13(18)4-5-14(12)19/h3-6,9,11H,7-8,10H2,1-2H3,(H2,20,21,22,24)