[2-[(3-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] (E)-3-(5-iodanylfuran-2-yl)prop-2-enoate

Systemtic Name: [2-[(3-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] (E)-3-(5-iodanylfuran-2-yl)prop-2-enoate Openeye Name: [2-(3-chloro-4-methyl-anilino)-2-oxo-1-phenyl-ethyl] (E)-3-(5-iodo-2-furyl)prop-2-enoate CAS Name: (E)-3-(5-iodo-2-furanyl)-2-propenoic acid [2-(3-chloro-4-methylanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(3-chloro-4-methylanilino)-2-oxo-1-phenylethyl] (E)-3-(5-iodofuran-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-iodo-2-furyl)acrylic acid [2-(3-chloro-4-methyl-anilino)-2-keto-1-phenyl-ethyl] ester Formula: C22H17ClINO4 MolecularWeight: 521.73215

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)C=CC3=CC=C(O3)I)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)/C=C/C3=CC=C(O3)I)Cl

InChI

InChI=1S/C22H17ClINO4/c1-14-7-8-16(13-18(14)23)25-22(27)21(15-5-3-2-4-6-15)29-20(26)12-10-17-9-11-19(24)28-17/h2-13,21H,1H3,(H,25,27)/b12-10+