4-chloranyl-N-[3-(5,5-dimethyl-1,3-dioxan-2-yl)phenyl]butanamide

Systemtic Name: 4-chloranyl-N-[3-(5,5-dimethyl-1,3-dioxan-2-yl)phenyl]butanamide Openeye Name: 4-chloro-N-[3-(5,5-dimethyl-1,3-dioxan-2-yl)phenyl]butanamide CAS Name: 4-chloro-N-[3-(5,5-dimethyl-1,3-dioxan-2-yl)phenyl]butanamide IUPAC Name: 4-chloro-N-[3-(5,5-dimethyl-1,3-dioxan-2-yl)phenyl]butanamide Traditional Name: 4-chloro-N-[3-(5,5-dimethyl-1,3-dioxan-2-yl)phenyl]butyramide Formula: C16H22ClNO3 MolecularWeight: 311.80378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(OC1)C2=CC(=CC=C2)NC(=O)CCCCl)C

Isomeric SMILES

CC1(COC(OC1)C2=CC(=CC=C2)NC(=O)CCCCl)C

InChI

InChI=1S/C16H22ClNO3/c1-16(2)10-20-15(21-11-16)12-5-3-6-13(9-12)18-14(19)7-4-8-17/h3,5-6,9,15H,4,7-8,10-11H2,1-2H3,(H,18,19)