methyl 2-[(R)-(4-bromophenyl)-(prop-2-enoxycarbonylamino)methyl]-3-oxidanylidene-butanoate

Systemtic Name: methyl 2-[(R)-(4-bromophenyl)-(prop-2-enoxycarbonylamino)methyl]-3-oxidanylidene-butanoate Openeye Name: methyl 2-[(R)-(allyloxycarbonylamino)-(4-bromophenyl)methyl]-3-oxo-butanoate CAS Name: 2-[(R)-(4-bromophenyl)-[[oxo(prop-2-enoxy)methyl]amino]methyl]-3-oxobutanoic acid methyl ester IUPAC Name: methyl 2-[(R)-(4-bromophenyl)-(prop-2-enoxycarbonylamino)methyl]-3-oxobutanoate Traditional Name: 2-[(R)-(allyloxycarbonylamino)-(4-bromophenyl)methyl]-3-keto-butyric acid methyl ester Formula: C16H18BrNO5 MolecularWeight: 384.22182

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(C1=CC=C(C=C1)Br)NC(=O)OCC=C)C(=O)OC

Isomeric SMILES

CC(=O)C([C@H](C1=CC=C(C=C1)Br)NC(=O)OCC=C)C(=O)OC

InChI

InChI=1S/C16H18BrNO5/c1-4-9-23-16(21)18-14(11-5-7-12(17)8-6-11)13(10(2)19)15(20)22-3/h4-8,13-14H,1,9H2,2-3H3,(H,18,21)/t13?,14-/m0/s1