(1S)-2-methyl-1-[1-[(2-methyl-1-benzofuran-7-yl)methyl]piperidin-1-ium-4-yl]propan-1-ol

Systemtic Name: (1S)-2-methyl-1-[1-[(2-methyl-1-benzofuran-7-yl)methyl]piperidin-1-ium-4-yl]propan-1-ol Openeye Name: (1S)-2-methyl-1-[1-[(2-methylbenzofuran-7-yl)methyl]piperidin-1-ium-4-yl]propan-1-ol CAS Name: (1S)-2-methyl-1-[1-[(2-methyl-7-benzofuranyl)methyl]-4-piperidin-1-iumyl]-1-propanol IUPAC Name: (1S)-2-methyl-1-[1-[(2-methyl-1-benzofuran-7-yl)methyl]piperidin-1-ium-4-yl]propan-1-ol Traditional Name: (1S)-2-methyl-1-[1-[(2-methylbenzofuran-7-yl)methyl]piperidin-1-ium-4-yl]propan-1-ol Formula: C19H28NO2+ MolecularWeight: 302.43112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(O1)C(=CC=C2)C[NH+]3CCC(CC3)C(C(C)C)O

Isomeric SMILES

CC1=CC2=C(O1)C(=CC=C2)C[NH+]3CCC(CC3)[C@H](C(C)C)O

InChI

InChI=1S/C19H27NO2/c1-13(2)18(21)15-7-9-20(10-8-15)12-17-6-4-5-16-11-14(3)22-19(16)17/h4-6,11,13,15,18,21H,7-10,12H2,1-3H3/p+1/t18-/m0/s1