1-[(2S)-4-(4-methoxyphenyl)butan-2-yl]-4-(phenylmethyl)piperidin-1-ium

Systemtic Name: 1-[(2S)-4-(4-methoxyphenyl)butan-2-yl]-4-(phenylmethyl)piperidin-1-ium Openeye Name: 4-benzyl-1-[(1S)-3-(4-methoxyphenyl)-1-methyl-propyl]piperidin-1-ium CAS Name: 1-[(2S)-4-(4-methoxyphenyl)butan-2-yl]-4-(phenylmethyl)piperidin-1-ium IUPAC Name: 4-benzyl-1-[(2S)-4-(4-methoxyphenyl)butan-2-yl]piperidin-1-ium Traditional Name: 4-benzyl-1-[(1S)-3-(4-methoxyphenyl)-1-methyl-propyl]piperidin-1-ium Formula: C23H32NO+ MolecularWeight: 338.50628

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)OC)[NH+]2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

C[C@@H](CCC1=CC=C(C=C1)OC)[NH+]2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C23H31NO/c1-19(8-9-20-10-12-23(25-2)13-11-20)24-16-14-22(15-17-24)18-21-6-4-3-5-7-21/h3-7,10-13,19,22H,8-9,14-18H2,1-2H3/p+1/t19-/m0/s1