4-[2-(azepan-1-yl)-2-oxo-ethoxy]-3-methoxy-benzonitrile
Molecular Formula:
C
16
H
20
N
2
O
3
InChI:
InChI=1/C16H20N2O3/c1-20-15-10-13(11-17)6-7-14(15)21-12-16(19)18-8-4-2-3-5-9-18/h6-7,10H,2-5,8-9,12H2,1H3
InChIKey:
InChIKey=JCBSEFPCPVOTPT-UHFFFAOYAA
SMILES:
COC1=C(C=CC(=C1)C#N)OCC(=O)N2CCCCCC2
Names:
4-[2-(azepan-1-yl)-2-oxo-ethoxy]-3-methoxy-benzonitrile
Registries:
PubChem CID 4820232
PubChem ID 9788727