4-azanyl-2-butyl-3-oxidanyl-3,4-dihydro-2H-chromene-6-carbonitrile

Systemtic Name: 4-azanyl-2-butyl-3-oxidanyl-3,4-dihydro-2H-chromene-6-carbonitrile Openeye Name: 4-amino-2-butyl-3-hydroxy-chromane-6-carbonitrile CAS Name: 4-amino-2-butyl-3-hydroxy-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 4-amino-2-butyl-3-hydroxy-3,4-dihydro-2H-chromene-6-carbonitrile Traditional Name: 4-amino-2-butyl-3-hydroxy-chroman-6-carbonitrile Formula: C14H18N2O2 MolecularWeight: 246.30492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(C(C2=C(O1)C=CC(=C2)C#N)N)O

Isomeric SMILES

CCCCC1C(C(C2=C(O1)C=CC(=C2)C#N)N)O

InChI

InChI=1S/C14H18N2O2/c1-2-3-4-12-14(17)13(16)10-7-9(8-15)5-6-11(10)18-12/h5-7,12-14,17H,2-4,16H2,1H3