[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxidanylidene-ethyl] (E)-3-(4-bromophenyl)prop-2-enoate

Systemtic Name: [2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxidanylidene-ethyl] (E)-3-(4-bromophenyl)prop-2-enoate Openeye Name: [2-(indan-5-ylamino)-2-oxo-ethyl] (E)-3-(4-bromophenyl)prop-2-enoate CAS Name: (E)-3-(4-bromophenyl)-2-propenoic acid [2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl] (E)-3-(4-bromophenyl)prop-2-enoate Traditional Name: (E)-3-(4-bromophenyl)acrylic acid [2-(indan-5-ylamino)-2-keto-ethyl] ester Formula: C20H18BrNO3 MolecularWeight: 400.26582

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)NC(=O)COC(=O)C=CC3=CC=C(C=C3)Br

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)NC(=O)COC(=O)/C=C/C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H18BrNO3/c21-17-8-4-14(5-9-17)6-11-20(24)25-13-19(23)22-18-10-7-15-2-1-3-16(15)12-18/h4-12H,1-3,13H2,(H,22,23)/b11-6+