[2-[(2-tert-butylphenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(3-fluorophenyl)prop-2-enoate

Systemtic Name: [2-[(2-tert-butylphenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(3-fluorophenyl)prop-2-enoate Openeye Name: [2-(2-tert-butylanilino)-2-oxo-ethyl] (E)-3-(3-fluorophenyl)prop-2-enoate CAS Name: (E)-3-(3-fluorophenyl)-2-propenoic acid [2-(2-tert-butylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-tert-butylanilino)-2-oxoethyl] (E)-3-(3-fluorophenyl)prop-2-enoate Traditional Name: (E)-3-(3-fluorophenyl)acrylic acid [2-(2-tert-butylanilino)-2-keto-ethyl] ester Formula: C21H22FNO3 MolecularWeight: 355.402683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1NC(=O)COC(=O)C=CC2=CC(=CC=C2)F

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1NC(=O)COC(=O)/C=C/C2=CC(=CC=C2)F

InChI

InChI=1S/C21H22FNO3/c1-21(2,3)17-9-4-5-10-18(17)23-19(24)14-26-20(25)12-11-15-7-6-8-16(22)13-15/h4-13H,14H2,1-3H3,(H,23,24)/b12-11+