(phenylmethyl) (Z)-3-(1,3-benzodioxol-5-yl)-2-[(3-bromophenyl)carbonylamino]prop-2-enoate

Systemtic Name: (phenylmethyl) (Z)-3-(1,3-benzodioxol-5-yl)-2-[(3-bromophenyl)carbonylamino]prop-2-enoate Openeye Name: benzyl (Z)-3-(1,3-benzodioxol-5-yl)-2-[(3-bromobenzoyl)amino]prop-2-enoate CAS Name: (Z)-3-(1,3-benzodioxol-5-yl)-2-[[(3-bromophenyl)-oxomethyl]amino]-2-propenoic acid (phenylmethyl) ester IUPAC Name: benzyl (Z)-3-(1,3-benzodioxol-5-yl)-2-[(3-bromobenzoyl)amino]prop-2-enoate Traditional Name: (Z)-3-(1,3-benzodioxol-5-yl)-2-[(3-bromobenzoyl)amino]acrylic acid benzyl ester Formula: C24H18BrNO5 MolecularWeight: 480.30742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C(C(=O)OCC3=CC=CC=C3)NC(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C(/C(=O)OCC3=CC=CC=C3)\NC(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C24H18BrNO5/c25-19-8-4-7-18(13-19)23(27)26-20(24(28)29-14-16-5-2-1-3-6-16)11-17-9-10-21-22(12-17)31-15-30-21/h1-13H,14-15H2,(H,26,27)/b20-11-