6-[[(E)-2-benzamido-3-(4-bromophenyl)prop-2-enoyl]amino]hexanoate

Systemtic Name: 6-[[(E)-2-benzamido-3-(4-bromophenyl)prop-2-enoyl]amino]hexanoate Openeye Name: 6-[[(E)-2-benzamido-3-(4-bromophenyl)prop-2-enoyl]amino]hexanoate CAS Name: 6-[[(E)-2-benzamido-3-(4-bromophenyl)-1-oxoprop-2-enyl]amino]hexanoate IUPAC Name: 6-[[(E)-2-benzamido-3-(4-bromophenyl)prop-2-enoyl]amino]hexanoate Traditional Name: 6-[[(E)-2-benzamido-3-(4-bromophenyl)acryloyl]amino]hexanoate Formula: C22H22BrN2O4- MolecularWeight: 458.32508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=CC2=CC=C(C=C2)Br)C(=O)NCCCCCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N/C(=C/C2=CC=C(C=C2)Br)/C(=O)NCCCCCC(=O)[O-]

InChI

InChI=1S/C22H23BrN2O4/c23-18-12-10-16(11-13-18)15-19(25-21(28)17-7-3-1-4-8-17)22(29)24-14-6-2-5-9-20(26)27/h1,3-4,7-8,10-13,15H,2,5-6,9,14H2,(H,24,29)(H,25,28)(H,26,27)/p-1/b19-15+