pentyl 4-[(2-bromanyl-3-phenyl-prop-2-enoyl)amino]benzoate

Systemtic Name: pentyl 4-[(2-bromanyl-3-phenyl-prop-2-enoyl)amino]benzoate Openeye Name: pentyl 4-[(2-bromo-3-phenyl-prop-2-enoyl)amino]benzoate CAS Name: 4-[(2-bromo-1-oxo-3-phenylprop-2-enyl)amino]benzoic acid pentyl ester IUPAC Name: pentyl 4-[(2-bromo-3-phenylprop-2-enoyl)amino]benzoate Traditional Name: 4-[(2-bromo-3-phenyl-acryloyl)amino]benzoic acid amyl ester Formula: C21H22BrNO3 MolecularWeight: 416.30828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(=CC2=CC=CC=C2)Br

Isomeric SMILES

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(=CC2=CC=CC=C2)Br

InChI

InChI=1S/C21H22BrNO3/c1-2-3-7-14-26-21(25)17-10-12-18(13-11-17)23-20(24)19(22)15-16-8-5-4-6-9-16/h4-6,8-13,15H,2-3,7,14H2,1H3,(H,23,24)