(1S)-3-methyl-1-[4-(piperidin-1-ium-4-ylmethyl)phenyl]butan-1-ol

Systemtic Name: (1S)-3-methyl-1-[4-(piperidin-1-ium-4-ylmethyl)phenyl]butan-1-ol Openeye Name: (1S)-3-methyl-1-[4-(piperidin-1-ium-4-ylmethyl)phenyl]butan-1-ol CAS Name: (1S)-3-methyl-1-[4-(4-piperidin-1-iumylmethyl)phenyl]-1-butanol IUPAC Name: (1S)-3-methyl-1-[4-(piperidin-1-ium-4-ylmethyl)phenyl]butan-1-ol Traditional Name: (1S)-3-methyl-1-[4-(piperidin-1-ium-4-ylmethyl)phenyl]butan-1-ol Formula: C17H28NO+ MolecularWeight: 262.41032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=C(C=C1)CC2CC[NH2+]CC2)O

Isomeric SMILES

CC(C)C[C@@H](C1=CC=C(C=C1)CC2CC[NH2+]CC2)O

InChI

InChI=1S/C17H27NO/c1-13(2)11-17(19)16-5-3-14(4-6-16)12-15-7-9-18-10-8-15/h3-6,13,15,17-19H,7-12H2,1-2H3/p+1/t17-/m0/s1