2-[(5,5-dimethyl-1,3-dioxan-2-yl)methyl]-3-ethanoyl-2,3,4,9-tetrahydro-1H-carbazole-1-carbonitrile

Systemtic Name: 2-[(5,5-dimethyl-1,3-dioxan-2-yl)methyl]-3-ethanoyl-2,3,4,9-tetrahydro-1H-carbazole-1-carbonitrile Openeye Name: 3-acetyl-2-[(5,5-dimethyl-1,3-dioxan-2-yl)methyl]-2,3,4,9-tetrahydro-1H-carbazole-1-carbonitrile CAS Name: 3-acetyl-2-[(5,5-dimethyl-1,3-dioxan-2-yl)methyl]-2,3,4,9-tetrahydro-1H-carbazole-1-carbonitrile IUPAC Name: 3-acetyl-2-[(5,5-dimethyl-1,3-dioxan-2-yl)methyl]-2,3,4,9-tetrahydro-1H-carbazole-1-carbonitrile Traditional Name: 3-acetyl-2-[(5,5-dimethyl-1,3-dioxan-2-yl)methyl]-2,3,4,9-tetrahydro-1H-carbazole-1-carbonitrile Formula: C22H26N2O3 MolecularWeight: 366.45344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1CC2=C(C(C1CC3OCC(CO3)(C)C)C#N)NC4=CC=CC=C24

Isomeric SMILES

CC(=O)C1CC2=C(C(C1CC3OCC(CO3)(C)C)C#N)NC4=CC=CC=C24

InChI

InChI=1S/C22H26N2O3/c1-13(25)15-8-17-14-6-4-5-7-19(14)24-21(17)18(10-23)16(15)9-20-26-11-22(2,3)12-27-20/h4-7,15-16,18,20,24H,8-9,11-12H2,1-3H3