ethanoic acid; 1-oxidanylcycloheptane-1-carbonitrile

Systemtic Name: ethanoic acid; 1-oxidanylcycloheptane-1-carbonitrile Openeye Name: acetic acid; 1-hydroxycycloheptanecarbonitrile CAS Name: acetic acid; 1-hydroxy-1-cycloheptanecarbonitrile IUPAC Name: acetic acid; 1-hydroxycycloheptane-1-carbonitrile Traditional Name: acetic acid; 1-hydroxycycloheptanecarbonitrile Formula: C10H17NO3 MolecularWeight: 199.24688

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1CCCC(CC1)(C#N)O

Isomeric SMILES

CC(=O)O.C1CCCC(CC1)(C#N)O

InChI

InChI=1S/C8H13NO.C2H4O2/c9-7-8(10)5-3-1-2-4-6-8;1-2(3)4/h10H,1-6H2;1H3,(H,3,4)