methyl (Z)-3-bromanyl-2-[[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]prop-2-enoate

Systemtic Name: methyl (Z)-3-bromanyl-2-[[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoyl]amino]prop-2-enoate Openeye Name: methyl (Z)-3-bromo-2-[[(2R)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]prop-2-enoate CAS Name: (Z)-3-bromo-2-[[(2R)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-3-phenylpropyl]amino]-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-3-bromo-2-[[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoyl]amino]prop-2-enoate Traditional Name: (Z)-3-bromo-2-[[(2R)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]acrylic acid methyl ester Formula: C18H23BrN2O5 MolecularWeight: 427.28962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)NC(=CBr)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H](CC1=CC=CC=C1)C(=O)N/C(=C\Br)/C(=O)OC

InChI

InChI=1S/C18H23BrN2O5/c1-18(2,3)26-17(24)21-13(10-12-8-6-5-7-9-12)15(22)20-14(11-19)16(23)25-4/h5-9,11,13H,10H2,1-4H3,(H,20,22)(H,21,24)/b14-11-/t13-/m1/s1