methyl 3-(4-bromophenyl)-2,2-dimethyl-3-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: methyl 3-(4-bromophenyl)-2,2-dimethyl-3-(phenylmethoxycarbonylamino)propanoate Openeye Name: methyl 3-(benzyloxycarbonylamino)-3-(4-bromophenyl)-2,2-dimethyl-propanoate CAS Name: 3-(4-bromophenyl)-2,2-dimethyl-3-(phenylmethoxycarbonylamino)propanoic acid methyl ester IUPAC Name: methyl 3-(4-bromophenyl)-2,2-dimethyl-3-(phenylmethoxycarbonylamino)propanoate Traditional Name: 3-(benzyloxycarbonylamino)-3-(4-bromophenyl)-2,2-dimethyl-propionic acid methyl ester Formula: C20H22BrNO4 MolecularWeight: 420.29698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22BrNO4/c1-20(2,18(23)25-3)17(15-9-11-16(21)12-10-15)22-19(24)26-13-14-7-5-4-6-8-14/h4-12,17H,13H2,1-3H3,(H,22,24)