methyl 2-[[(S)-(3-bromophenyl)-cyano-methyl]amino]ethanoate

Systemtic Name: methyl 2-[[(S)-(3-bromophenyl)-cyano-methyl]amino]ethanoate Openeye Name: methyl 2-[[(S)-(3-bromophenyl)-cyano-methyl]amino]acetate CAS Name: 2-[[(S)-(3-bromophenyl)-cyanomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[(S)-(3-bromophenyl)-cyanomethyl]amino]acetate Traditional Name: 2-[[(S)-(3-bromophenyl)-cyano-methyl]amino]acetic acid methyl ester Formula: C11H11BrN2O2 MolecularWeight: 283.12124

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(C#N)C1=CC(=CC=C1)Br

Isomeric SMILES

COC(=O)CN[C@H](C#N)C1=CC(=CC=C1)Br

InChI

InChI=1S/C11H11BrN2O2/c1-16-11(15)7-14-10(6-13)8-3-2-4-9(12)5-8/h2-5,10,14H,7H2,1H3/t10-/m1/s1