methyl 2-[[(E)-3-(2-chloranyl-6-fluoranyl-phenyl)prop-2-enoyl]amino]-3-methyl-butanoate

Systemtic Name: methyl 2-[[(E)-3-(2-chloranyl-6-fluoranyl-phenyl)prop-2-enoyl]amino]-3-methyl-butanoate Openeye Name: methyl 2-[[(E)-3-(2-chloro-6-fluoro-phenyl)prop-2-enoyl]amino]-3-methyl-butanoate CAS Name: 2-[[(E)-3-(2-chloro-6-fluorophenyl)-1-oxoprop-2-enyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[[(E)-3-(2-chloro-6-fluorophenyl)prop-2-enoyl]amino]-3-methylbutanoate Traditional Name: 2-[[(E)-3-(2-chloro-6-fluoro-phenyl)acryloyl]amino]-3-methyl-butyric acid methyl ester Formula: C15H17ClFNO3 MolecularWeight: 313.751783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)C=CC1=C(C=CC=C1Cl)F

Isomeric SMILES

CC(C)C(C(=O)OC)NC(=O)/C=C/C1=C(C=CC=C1Cl)F

InChI

InChI=1S/C15H17ClFNO3/c1-9(2)14(15(20)21-3)18-13(19)8-7-10-11(16)5-4-6-12(10)17/h4-9,14H,1-3H3,(H,18,19)/b8-7+