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

Systemtic Name: 1-[6-chloranyl-5-[(E)-prop-1-enyl]pyridin-3-yl]-1,4-diazepane Openeye Name: 1-[6-chloro-5-[(E)-prop-1-enyl]-3-pyridyl]-1,4-diazepane CAS Name: 1-[6-chloro-5-[(E)-prop-1-enyl]-3-pyridinyl]-1,4-diazepane IUPAC Name: 1-[6-chloro-5-[(E)-prop-1-enyl]pyridin-3-yl]-1,4-diazepane Traditional Name: 1-[6-chloro-5-[(E)-prop-1-enyl]-3-pyridyl]-1,4-diazepane Formula: C13H18ClN3 MolecularWeight: 251.75512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18ClN3/c1-2-4-11-9-12(10-16-13(11)14)17-7-3-5-15-6-8-17/h2,4,9-10,15H,3,5-8H2,1H3/b4-2+