ethyl 2-[[(E)-2-[(4-bromophenyl)carbonylamino]-3-phenyl-prop-2-enoyl]amino]ethanoate

Systemtic Name: ethyl 2-[[(E)-2-[(4-bromophenyl)carbonylamino]-3-phenyl-prop-2-enoyl]amino]ethanoate Openeye Name: ethyl 2-[[(E)-2-[(4-bromobenzoyl)amino]-3-phenyl-prop-2-enoyl]amino]acetate CAS Name: 2-[[(E)-2-[[(4-bromophenyl)-oxomethyl]amino]-1-oxo-3-phenylprop-2-enyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-2-[(4-bromobenzoyl)amino]-3-phenylprop-2-enoyl]amino]acetate Traditional Name: 2-[[(E)-2-[(4-bromobenzoyl)amino]-3-phenyl-acryloyl]amino]acetic acid ethyl ester Formula: C20H19BrN2O4 MolecularWeight: 431.27986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)C(=CC1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCOC(=O)CNC(=O)/C(=C\C1=CC=CC=C1)/NC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C20H19BrN2O4/c1-2-27-18(24)13-22-20(26)17(12-14-6-4-3-5-7-14)23-19(25)15-8-10-16(21)11-9-15/h3-12H,2,13H2,1H3,(H,22,26)(H,23,25)/b17-12+