[2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(5-bromanylfuran-2-yl)prop-2-enoate

Systemtic Name: [2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(5-bromanylfuran-2-yl)prop-2-enoate Openeye Name: [2-(3-chloro-4-cyano-anilino)-2-oxo-ethyl] (E)-3-(5-bromo-2-furyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-2-furanyl)-2-propenoic acid [2-(3-chloro-4-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-chloro-4-cyanoanilino)-2-oxoethyl] (E)-3-(5-bromofuran-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-bromo-2-furyl)acrylic acid [2-(3-chloro-4-cyano-anilino)-2-keto-ethyl] ester Formula: C16H10BrClN2O4 MolecularWeight: 409.6186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)COC(=O)C=CC2=CC=C(O2)Br)Cl)C#N

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)COC(=O)/C=C/C2=CC=C(O2)Br)Cl)C#N

InChI

InChI=1S/C16H10BrClN2O4/c17-14-5-3-12(24-14)4-6-16(22)23-9-15(21)20-11-2-1-10(8-19)13(18)7-11/h1-7H,9H2,(H,20,21)/b6-4+