5-azanyl-2-(2,2-dimethylpropoxy)benzenecarbonitrile; ethyl ethanoate

Systemtic Name: 5-azanyl-2-(2,2-dimethylpropoxy)benzenecarbonitrile; ethyl ethanoate Openeye Name: 5-amino-2-(2,2-dimethylpropoxy)benzonitrile; ethyl acetate CAS Name: acetic acid ethyl ester; 5-amino-2-(2,2-dimethylpropoxy)benzonitrile IUPAC Name: 5-amino-2-(2,2-dimethylpropoxy)benzonitrile; ethyl acetate Traditional Name: acetic acid ethyl ester; 5-amino-2-neopentyloxy-benzonitrile Formula: C16H24N2O3 MolecularWeight: 292.37336

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C.CC(C)(C)COC1=C(C=C(C=C1)N)C#N

Isomeric SMILES

CCOC(=O)C.CC(C)(C)COC1=C(C=C(C=C1)N)C#N

InChI

InChI=1S/C12H16N2O.C4H8O2/c1-12(2,3)8-15-11-5-4-10(14)6-9(11)7-13;1-3-6-4(2)5/h4-6H,8,14H2,1-3H3;3H2,1-2H3