methyl (Z)-3-(2-bromanyl-3,4,5-trimethoxy-phenyl)-2-(phenylmethoxycarbonylamino)prop-2-enoate

Systemtic Name: methyl (Z)-3-(2-bromanyl-3,4,5-trimethoxy-phenyl)-2-(phenylmethoxycarbonylamino)prop-2-enoate Openeye Name: methyl (Z)-2-(benzyloxycarbonylamino)-3-(2-bromo-3,4,5-trimethoxy-phenyl)prop-2-enoate CAS Name: (Z)-3-(2-bromo-3,4,5-trimethoxyphenyl)-2-(phenylmethoxycarbonylamino)-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-3-(2-bromo-3,4,5-trimethoxyphenyl)-2-(phenylmethoxycarbonylamino)prop-2-enoate Traditional Name: (Z)-2-(benzyloxycarbonylamino)-3-(2-bromo-3,4,5-trimethoxy-phenyl)acrylic acid methyl ester Formula: C21H22BrNO7 MolecularWeight: 480.30588

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C=C(C(=O)OC)NC(=O)OCC2=CC=CC=C2)Br)OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)/C=C(/C(=O)OC)\NC(=O)OCC2=CC=CC=C2)Br)OC)OC

InChI

InChI=1S/C21H22BrNO7/c1-26-16-11-14(17(22)19(28-3)18(16)27-2)10-15(20(24)29-4)23-21(25)30-12-13-8-6-5-7-9-13/h5-11H,12H2,1-4H3,(H,23,25)/b15-10-