2,2-bis(hydroxymethyl)-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 2,2-bis(hydroxymethyl)-3,4-dihydrochromene-6-carbonitrile Openeye Name: 2,2-bis(hydroxymethyl)chromane-6-carbonitrile CAS Name: 2,2-bis(hydroxymethyl)-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 2,2-bis(hydroxymethyl)-3,4-dihydrochromene-6-carbonitrile Traditional Name: 2,2-dimethylolchroman-6-carbonitrile Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC2=C1C=C(C=C2)C#N)(CO)CO

Isomeric SMILES

C1CC(OC2=C1C=C(C=C2)C#N)(CO)CO

InChI

InChI=1S/C12H13NO3/c13-6-9-1-2-11-10(5-9)3-4-12(7-14,8-15)16-11/h1-2,5,14-15H,3-4,7-8H2