(3S)-3-methyl-1-[3-(4-methyl-2-prop-2-enyl-phenoxy)propyl]piperidin-1-ium

Systemtic Name: (3S)-3-methyl-1-[3-(4-methyl-2-prop-2-enyl-phenoxy)propyl]piperidin-1-ium Openeye Name: (3S)-1-[3-(2-allyl-4-methyl-phenoxy)propyl]-3-methyl-piperidin-1-ium CAS Name: (3S)-3-methyl-1-[3-(4-methyl-2-prop-2-enylphenoxy)propyl]piperidin-1-ium IUPAC Name: (3S)-3-methyl-1-[3-(4-methyl-2-prop-2-enylphenoxy)propyl]piperidin-1-ium Traditional Name: (3S)-1-[3-(2-allyl-4-methyl-phenoxy)propyl]-3-methyl-piperidin-1-ium Formula: C19H30NO+ MolecularWeight: 288.4476

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCCOC2=C(C=C(C=C2)C)CC=C

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CCCOC2=C(C=C(C=C2)C)CC=C

InChI

InChI=1S/C19H29NO/c1-4-7-18-14-16(2)9-10-19(18)21-13-6-12-20-11-5-8-17(3)15-20/h4,9-10,14,17H,1,5-8,11-13,15H2,2-3H3/p+1/t17-/m0/s1