4-[[(Z)-2-[(2-bromophenyl)carbonylamino]-3-(furan-2-yl)prop-2-enoyl]amino]benzoate

Systemtic Name: 4-[[(Z)-2-[(2-bromophenyl)carbonylamino]-3-(furan-2-yl)prop-2-enoyl]amino]benzoate Openeye Name: 4-[[(Z)-2-[(2-bromobenzoyl)amino]-3-(2-furyl)prop-2-enoyl]amino]benzoate CAS Name: 4-[[(Z)-2-[[(2-bromophenyl)-oxomethyl]amino]-3-(2-furanyl)-1-oxoprop-2-enyl]amino]benzoate IUPAC Name: 4-[[(Z)-2-[(2-bromobenzoyl)amino]-3-(furan-2-yl)prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(Z)-2-[(2-bromobenzoyl)amino]-3-(2-furyl)acryloyl]amino]benzoate Formula: C21H14BrN2O5- MolecularWeight: 454.25026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC(=CC2=CC=CO2)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=CO2)/C(=O)NC3=CC=C(C=C3)C(=O)[O-])Br

InChI

InChI=1S/C21H15BrN2O5/c22-17-6-2-1-5-16(17)19(25)24-18(12-15-4-3-11-29-15)20(26)23-14-9-7-13(8-10-14)21(27)28/h1-12H,(H,23,26)(H,24,25)(H,27,28)/p-1/b18-12-