[2-oxidanylidene-2-[[(2R)-pentan-2-yl]amino]ethyl] (E)-3-(2-bromophenyl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-[[(2R)-pentan-2-yl]amino]ethyl] (E)-3-(2-bromophenyl)prop-2-enoate Openeye Name: [2-[[(1R)-1-methylbutyl]amino]-2-oxo-ethyl] (E)-3-(2-bromophenyl)prop-2-enoate CAS Name: (E)-3-(2-bromophenyl)-2-propenoic acid [2-oxo-2-[[(2R)-pentan-2-yl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2R)-pentan-2-yl]amino]ethyl] (E)-3-(2-bromophenyl)prop-2-enoate Traditional Name: (E)-3-(2-bromophenyl)acrylic acid [2-keto-2-[[(1R)-1-methylbutyl]amino]ethyl] ester Formula: C16H20BrNO3 MolecularWeight: 354.2389

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)COC(=O)C=CC1=CC=CC=C1Br

Isomeric SMILES

CCC[C@@H](C)NC(=O)COC(=O)/C=C/C1=CC=CC=C1Br

InChI

InChI=1S/C16H20BrNO3/c1-3-6-12(2)18-15(19)11-21-16(20)10-9-13-7-4-5-8-14(13)17/h4-5,7-10,12H,3,6,11H2,1-2H3,(H,18,19)/b10-9+/t12-/m1/s1