4-[3-[(4-chlorophenyl)amino]prop-1-ynyl]-1-methyl-piperidin-1-ium-4-ol

Systemtic Name: 4-[3-[(4-chlorophenyl)amino]prop-1-ynyl]-1-methyl-piperidin-1-ium-4-ol Openeye Name: 4-[3-(4-chloroanilino)prop-1-ynyl]-1-methyl-piperidin-1-ium-4-ol CAS Name: 4-[3-(4-chloroanilino)prop-1-ynyl]-1-methyl-4-piperidin-1-iumol IUPAC Name: 4-[3-(4-chloroanilino)prop-1-ynyl]-1-methylpiperidin-1-ium-4-ol Traditional Name: 4-[3-(4-chloroanilino)prop-1-ynyl]-1-methyl-piperidin-1-ium-4-ol Formula: C15H20ClN2O+ MolecularWeight: 279.7851

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)(C#CCNC2=CC=C(C=C2)Cl)O

Isomeric SMILES

C[NH+]1CCC(CC1)(C#CCNC2=CC=C(C=C2)Cl)O

InChI

InChI=1S/C15H19ClN2O/c1-18-11-8-15(19,9-12-18)7-2-10-17-14-5-3-13(16)4-6-14/h3-6,17,19H,8-12H2,1H3/p+1