1-[5-[(E)-but-1-enyl]-6-chloranyl-pyridin-3-yl]-1,4-diazepane

Systemtic Name: 1-[5-[(E)-but-1-enyl]-6-chloranyl-pyridin-3-yl]-1,4-diazepane Openeye Name: 1-[5-[(E)-but-1-enyl]-6-chloro-3-pyridyl]-1,4-diazepane CAS Name: 1-[5-[(E)-but-1-enyl]-6-chloro-3-pyridinyl]-1,4-diazepane IUPAC Name: 1-[5-[(E)-but-1-enyl]-6-chloropyridin-3-yl]-1,4-diazepane Traditional Name: 1-[5-[(E)-but-1-enyl]-6-chloro-3-pyridyl]-1,4-diazepane Formula: C14H20ClN3 MolecularWeight: 265.7817

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC=CC1=CC(=CN=C1Cl)N2CCCNCC2

Isomeric SMILES

CC/C=C/C1=CC(=CN=C1Cl)N2CCCNCC2

InChI

InChI=1S/C14H20ClN3/c1-2-3-5-12-10-13(11-17-14(12)15)18-8-4-6-16-7-9-18/h3,5,10-11,16H,2,4,6-9H2,1H3/b5-3+