3-[[(E)-2-benzamido-3-(3-bromophenyl)prop-2-enoyl]amino]propanoate

Systemtic Name: 3-[[(E)-2-benzamido-3-(3-bromophenyl)prop-2-enoyl]amino]propanoate Openeye Name: 3-[[(E)-2-benzamido-3-(3-bromophenyl)prop-2-enoyl]amino]propanoate CAS Name: 3-[[(E)-2-benzamido-3-(3-bromophenyl)-1-oxoprop-2-enyl]amino]propanoate IUPAC Name: 3-[[(E)-2-benzamido-3-(3-bromophenyl)prop-2-enoyl]amino]propanoate Traditional Name: 3-[[(E)-2-benzamido-3-(3-bromophenyl)acryloyl]amino]propionate Formula: C19H16BrN2O4- MolecularWeight: 416.24534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17BrN2O4/c20-15-8-4-5-13(11-15)12-16(19(26)21-10-9-17(23)24)22-18(25)14-6-2-1-3-7-14/h1-8,11-12H,9-10H2,(H,21,26)(H,22,25)(H,23,24)/p-1/b16-12+