diethyl-[5-(4-methoxyphenyl)-5-phenyl-pent-2-ynyl]azanium

Systemtic Name: diethyl-[5-(4-methoxyphenyl)-5-phenyl-pent-2-ynyl]azanium Openeye Name: diethyl-[5-(4-methoxyphenyl)-5-phenyl-pent-2-ynyl]ammonium CAS Name: diethyl-[5-(4-methoxyphenyl)-5-phenylpent-2-ynyl]ammonium IUPAC Name: diethyl-[5-(4-methoxyphenyl)-5-phenylpent-2-ynyl]azanium Traditional Name: diethyl-[5-(4-methoxyphenyl)-5-phenyl-pent-2-ynyl]ammonium Formula: C22H28NO+ MolecularWeight: 322.46382

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC#CCC(C1=CC=CC=C1)C2=CC=C(C=C2)OC

Isomeric SMILES

CC[NH+](CC)CC#CCC(C1=CC=CC=C1)C2=CC=C(C=C2)OC

InChI

InChI=1S/C22H27NO/c1-4-23(5-2)18-10-9-13-22(19-11-7-6-8-12-19)20-14-16-21(24-3)17-15-20/h6-8,11-12,14-17,22H,4-5,13,18H2,1-3H3/p+1