methyl 6-[[(E)-3-(3-bromophenyl)prop-2-enoyl]amino]hexanoate

Systemtic Name: methyl 6-[[(E)-3-(3-bromophenyl)prop-2-enoyl]amino]hexanoate Openeye Name: methyl 6-[[(E)-3-(3-bromophenyl)prop-2-enoyl]amino]hexanoate CAS Name: 6-[[(E)-3-(3-bromophenyl)-1-oxoprop-2-enyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[(E)-3-(3-bromophenyl)prop-2-enoyl]amino]hexanoate Traditional Name: 6-[[(E)-3-(3-bromophenyl)acryloyl]amino]hexanoic acid methyl ester Formula: C16H20BrNO3 MolecularWeight: 354.2389

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)C=CC1=CC(=CC=C1)Br

Isomeric SMILES

COC(=O)CCCCCNC(=O)/C=C/C1=CC(=CC=C1)Br

InChI

InChI=1S/C16H20BrNO3/c1-21-16(20)8-3-2-4-11-18-15(19)10-9-13-6-5-7-14(17)12-13/h5-7,9-10,12H,2-4,8,11H2,1H3,(H,18,19)/b10-9+