3-[cyclohexyl-[(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl]amino]propanenitrile hydrochloride

Systemtic Name: 3-[cyclohexyl-[(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl]amino]propanenitrile hydrochloride Openeye Name: 3-[cyclohexyl-[(7-hydroxy-4-methyl-2-oxo-chromen-8-yl)methyl]amino]propanenitrile hydrochloride CAS Name: 3-[cyclohexyl-[(7-hydroxy-4-methyl-2-oxo-1-benzopyran-8-yl)methyl]amino]propanenitrile hydrochloride IUPAC Name: 3-[cyclohexyl-[(7-hydroxy-4-methyl-2-oxochromen-8-yl)methyl]amino]propanenitrile hydrochloride Traditional Name: 3-[cyclohexyl-[(7-hydroxy-2-keto-4-methyl-chromen-8-yl)methyl]amino]propionitrile hydrochloride Formula: C20H25ClN2O3 MolecularWeight: 376.8771

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2CN(CCC#N)C3CCCCC3)O.Cl

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2CN(CCC#N)C3CCCCC3)O.Cl

InChI

InChI=1S/C20H24N2O3.ClH/c1-14-12-19(24)25-20-16(14)8-9-18(23)17(20)13-22(11-5-10-21)15-6-3-2-4-7-15;/h8-9,12,15,23H,2-7,11,13H2,1H3;1H