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

Systemtic Name: 4-[3-[(4-methoxyphenyl)amino]prop-1-ynyl]-1-methyl-piperidin-1-ium-4-ol Openeye Name: 4-[3-(4-methoxyanilino)prop-1-ynyl]-1-methyl-piperidin-1-ium-4-ol CAS Name: 4-[3-(4-methoxyanilino)prop-1-ynyl]-1-methyl-4-piperidin-1-iumol IUPAC Name: 4-[3-(4-methoxyanilino)prop-1-ynyl]-1-methylpiperidin-1-ium-4-ol Traditional Name: 1-methyl-4-[3-(p-anisidino)prop-1-ynyl]piperidin-1-ium-4-ol Formula: C16H23N2O2+ MolecularWeight: 275.36602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O2/c1-18-12-9-16(19,10-13-18)8-3-11-17-14-4-6-15(20-2)7-5-14/h4-7,17,19H,9-13H2,1-2H3/p+1