4-(4-chloranylphenoxy)but-2-ynyl-[(1S,2R)-2-methylcyclohexyl]azanium

Systemtic Name: 4-(4-chloranylphenoxy)but-2-ynyl-[(1S,2R)-2-methylcyclohexyl]azanium Openeye Name: 4-(4-chlorophenoxy)but-2-ynyl-[(1S,2R)-2-methylcyclohexyl]ammonium CAS Name: 4-(4-chlorophenoxy)but-2-ynyl-[(1S,2R)-2-methylcyclohexyl]ammonium IUPAC Name: 4-(4-chlorophenoxy)but-2-ynyl-[(1S,2R)-2-methylcyclohexyl]azanium Traditional Name: 4-(4-chlorophenoxy)but-2-ynyl-[(1S,2R)-2-methylcyclohexyl]ammonium Formula: C17H23ClNO+ MolecularWeight: 292.82362

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1[NH2+]CC#CCOC2=CC=C(C=C2)Cl

Isomeric SMILES

C[C@@H]1CCCC[C@@H]1[NH2+]CC#CCOC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H22ClNO/c1-14-6-2-3-7-17(14)19-12-4-5-13-20-16-10-8-15(18)9-11-16/h8-11,14,17,19H,2-3,6-7,12-13H2,1H3/p+1/t14-,17+/m1/s1