4-(4-chloranylphenoxy)but-2-ynyl-propan-2-yl-azanium

Systemtic Name: 4-(4-chloranylphenoxy)but-2-ynyl-propan-2-yl-azanium Openeye Name: 4-(4-chlorophenoxy)but-2-ynyl-isopropyl-ammonium CAS Name: 4-(4-chlorophenoxy)but-2-ynyl-propan-2-ylammonium IUPAC Name: 4-(4-chlorophenoxy)but-2-ynyl-propan-2-ylazanium Traditional Name: 4-(4-chlorophenoxy)but-2-ynyl-isopropyl-ammonium Formula: C13H17ClNO+ MolecularWeight: 238.73318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH2+]CC#CCOC1=CC=C(C=C1)Cl

Isomeric SMILES

CC(C)[NH2+]CC#CCOC1=CC=C(C=C1)Cl

InChI

InChI=1S/C13H16ClNO/c1-11(2)15-9-3-4-10-16-13-7-5-12(14)6-8-13/h5-8,11,15H,9-10H2,1-2H3/p+1