4-[[(E)-2-[(2-bromophenyl)carbonylamino]-3-(4-nitrophenyl)prop-2-enoyl]amino]benzoate

Systemtic Name: 4-[[(E)-2-[(2-bromophenyl)carbonylamino]-3-(4-nitrophenyl)prop-2-enoyl]amino]benzoate Openeye Name: 4-[[(E)-2-[(2-bromobenzoyl)amino]-3-(4-nitrophenyl)prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-2-[[(2-bromophenyl)-oxomethyl]amino]-3-(4-nitrophenyl)-1-oxoprop-2-enyl]amino]benzoate IUPAC Name: 4-[[(E)-2-[(2-bromobenzoyl)amino]-3-(4-nitrophenyl)prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-2-[(2-bromobenzoyl)amino]-3-(4-nitrophenyl)acryloyl]amino]benzoate Formula: C23H15BrN3O6- MolecularWeight: 509.2857

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC(=CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=C(C=C3)C(=O)[O-])Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)N/C(=C/C2=CC=C(C=C2)[N+](=O)[O-])/C(=O)NC3=CC=C(C=C3)C(=O)[O-])Br

InChI

InChI=1S/C23H16BrN3O6/c24-19-4-2-1-3-18(19)21(28)26-20(13-14-5-11-17(12-6-14)27(32)33)22(29)25-16-9-7-15(8-10-16)23(30)31/h1-13H,(H,25,29)(H,26,28)(H,30,31)/p-1/b20-13+