4-(4-chloranylphenoxy)but-2-ynyl-ethyl-azanium

Systemtic Name: 4-(4-chloranylphenoxy)but-2-ynyl-ethyl-azanium Openeye Name: 4-(4-chlorophenoxy)but-2-ynyl-ethyl-ammonium CAS Name: 4-(4-chlorophenoxy)but-2-ynyl-ethylammonium IUPAC Name: 4-(4-chlorophenoxy)but-2-ynyl-ethylazanium Traditional Name: 4-(4-chlorophenoxy)but-2-ynyl-ethyl-ammonium Formula: C12H15ClNO+ MolecularWeight: 224.7066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14ClNO/c1-2-14-9-3-4-10-15-12-7-5-11(13)6-8-12/h5-8,14H,2,9-10H2,1H3/p+1