(phenylmethyl) (3S)-3-azanyl-4-(3-cyanophenoxy)butanoate

Systemtic Name: (phenylmethyl) (3S)-3-azanyl-4-(3-cyanophenoxy)butanoate Openeye Name: benzyl (3S)-3-amino-4-(3-cyanophenoxy)butanoate CAS Name: (3S)-3-amino-4-(3-cyanophenoxy)butanoic acid (phenylmethyl) ester IUPAC Name: benzyl (3S)-3-amino-4-(3-cyanophenoxy)butanoate Traditional Name: (3S)-3-amino-4-(3-cyanophenoxy)butyric acid benzyl ester Formula: C18H18N2O3 MolecularWeight: 310.34712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CC(COC2=CC=CC(=C2)C#N)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C[C@@H](COC2=CC=CC(=C2)C#N)N

InChI

InChI=1S/C18H18N2O3/c19-11-15-7-4-8-17(9-15)22-13-16(20)10-18(21)23-12-14-5-2-1-3-6-14/h1-9,16H,10,12-13,20H2/t16-/m0/s1