propan-2-yl (E)-3-[4-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethoxy]-3-methoxy-phenyl]-2-cyano-prop-2-enoate

Systemtic Name: propan-2-yl (E)-3-[4-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethoxy]-3-methoxy-phenyl]-2-cyano-prop-2-enoate Openeye Name: isopropyl (E)-3-[4-[2-(4-bromoanilino)-2-oxo-ethoxy]-3-methoxy-phenyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[4-[2-(4-bromoanilino)-2-oxoethoxy]-3-methoxyphenyl]-2-cyano-2-propenoic acid propan-2-yl ester IUPAC Name: propan-2-yl (E)-3-[4-[2-(4-bromoanilino)-2-oxoethoxy]-3-methoxyphenyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[4-[2-(4-bromoanilino)-2-keto-ethoxy]-3-methoxy-phenyl]-2-cyano-acrylic acid isopropyl ester Formula: C22H21BrN2O5 MolecularWeight: 473.31654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(=CC1=CC(=C(C=C1)OCC(=O)NC2=CC=C(C=C2)Br)OC)C#N

Isomeric SMILES

CC(C)OC(=O)/C(=C/C1=CC(=C(C=C1)OCC(=O)NC2=CC=C(C=C2)Br)OC)/C#N

InChI

InChI=1S/C22H21BrN2O5/c1-14(2)30-22(27)16(12-24)10-15-4-9-19(20(11-15)28-3)29-13-21(26)25-18-7-5-17(23)6-8-18/h4-11,14H,13H2,1-3H3,(H,25,26)/b16-10+