3-oxidanyl-2-phenyl-butanenitrile; (phenylmethyl) carbamate

Systemtic Name: 3-oxidanyl-2-phenyl-butanenitrile; (phenylmethyl) carbamate Openeye Name: benzyl carbamate; 3-hydroxy-2-phenyl-butanenitrile CAS Name: carbamic acid (phenylmethyl) ester; 3-hydroxy-2-phenylbutanenitrile IUPAC Name: benzyl carbamate; 3-hydroxy-2-phenylbutanenitrile Traditional Name: carbamic acid benzyl ester; 3-hydroxy-2-phenyl-butyronitrile Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C#N)C1=CC=CC=C1)O.C1=CC=C(C=C1)COC(=O)N

Isomeric SMILES

CC(C(C#N)C1=CC=CC=C1)O.C1=CC=C(C=C1)COC(=O)N

InChI

InChI=1S/C10H11NO.C8H9NO2/c1-8(12)10(7-11)9-5-3-2-4-6-9;9-8(10)11-6-7-4-2-1-3-5-7/h2-6,8,10,12H,1H3;1-5H,6H2,(H2,9,10)