[2-oxidanylidene-2-[(4-phenylazanylphenyl)-propan-2-yl-amino]ethyl] (E)-3-(3-fluorophenyl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-[(4-phenylazanylphenyl)-propan-2-yl-amino]ethyl] (E)-3-(3-fluorophenyl)prop-2-enoate Openeye Name: [2-(4-anilino-N-isopropyl-anilino)-2-oxo-ethyl] (E)-3-(3-fluorophenyl)prop-2-enoate CAS Name: (E)-3-(3-fluorophenyl)-2-propenoic acid [2-(4-anilino-N-propan-2-ylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-anilino-N-propan-2-ylanilino)-2-oxoethyl] (E)-3-(3-fluorophenyl)prop-2-enoate Traditional Name: (E)-3-(3-fluorophenyl)acrylic acid [2-(4-anilino-N-isopropyl-anilino)-2-keto-ethyl] ester Formula: C26H25FN2O3 MolecularWeight: 432.486703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=C(C=C1)NC2=CC=CC=C2)C(=O)COC(=O)C=CC3=CC(=CC=C3)F

Isomeric SMILES

CC(C)N(C1=CC=C(C=C1)NC2=CC=CC=C2)C(=O)COC(=O)/C=C/C3=CC(=CC=C3)F

InChI

InChI=1S/C26H25FN2O3/c1-19(2)29(24-14-12-23(13-15-24)28-22-9-4-3-5-10-22)25(30)18-32-26(31)16-11-20-7-6-8-21(27)17-20/h3-17,19,28H,18H2,1-2H3/b16-11+