[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxidanylidene-ethyl] (E)-3-(3-bromophenyl)prop-2-enoate

Systemtic Name: [2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxidanylidene-ethyl] (E)-3-(3-bromophenyl)prop-2-enoate Openeye Name: [2-[(2S)-2-methylindolin-1-yl]-2-oxo-ethyl] (E)-3-(3-bromophenyl)prop-2-enoate CAS Name: (E)-3-(3-bromophenyl)-2-propenoic acid [2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl] ester IUPAC Name: [2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-2-oxoethyl] (E)-3-(3-bromophenyl)prop-2-enoate Traditional Name: (E)-3-(3-bromophenyl)acrylic acid [2-keto-2-[(2S)-2-methylindolin-1-yl]ethyl] ester Formula: C20H18BrNO3 MolecularWeight: 400.26582

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)COC(=O)C=CC3=CC(=CC=C3)Br

Isomeric SMILES

C[C@H]1CC2=CC=CC=C2N1C(=O)COC(=O)/C=C/C3=CC(=CC=C3)Br

InChI

InChI=1S/C20H18BrNO3/c1-14-11-16-6-2-3-8-18(16)22(14)19(23)13-25-20(24)10-9-15-5-4-7-17(21)12-15/h2-10,12,14H,11,13H2,1H3/b10-9+/t14-/m0/s1