prop-2-enyl (E)-2-[(5-bromanylfuran-2-yl)carbonylamino]-3-(4-nitrophenyl)prop-2-enoate

Systemtic Name: prop-2-enyl (E)-2-[(5-bromanylfuran-2-yl)carbonylamino]-3-(4-nitrophenyl)prop-2-enoate Openeye Name: allyl (E)-2-[(5-bromofuran-2-carbonyl)amino]-3-(4-nitrophenyl)prop-2-enoate CAS Name: (E)-2-[[(5-bromo-2-furanyl)-oxomethyl]amino]-3-(4-nitrophenyl)-2-propenoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (E)-2-[(5-bromofuran-2-carbonyl)amino]-3-(4-nitrophenyl)prop-2-enoate Traditional Name: (E)-2-[(5-bromo-2-furoyl)amino]-3-(4-nitrophenyl)acrylic acid allyl ester Formula: C17H13BrN2O6 MolecularWeight: 421.19892

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)C(=CC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)C2=CC=C(O2)Br

Isomeric SMILES

C=CCOC(=O)/C(=C\C1=CC=C(C=C1)[N+](=O)[O-])/NC(=O)C2=CC=C(O2)Br

InChI

InChI=1S/C17H13BrN2O6/c1-2-9-25-17(22)13(19-16(21)14-7-8-15(18)26-14)10-11-3-5-12(6-4-11)20(23)24/h2-8,10H,1,9H2,(H,19,21)/b13-10+