1-[(3S)-1-[(2-ethoxyphenyl)methyl]piperidin-3-yl]-4-phenyl-piperazin-1-ium

Systemtic Name: 1-[(3S)-1-[(2-ethoxyphenyl)methyl]piperidin-3-yl]-4-phenyl-piperazin-1-ium Openeye Name: 1-[(3S)-1-[(2-ethoxyphenyl)methyl]-3-piperidyl]-4-phenyl-piperazin-1-ium CAS Name: 1-[(3S)-1-[(2-ethoxyphenyl)methyl]-3-piperidinyl]-4-phenylpiperazin-1-ium IUPAC Name: 1-[(3S)-1-[(2-ethoxyphenyl)methyl]piperidin-3-yl]-4-phenylpiperazin-1-ium Traditional Name: 1-[(3S)-1-(2-ethoxybenzyl)-3-piperidyl]-4-phenyl-piperazin-1-ium Formula: C24H34N3O+ MolecularWeight: 380.54626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CN2CCCC(C2)[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=CC=C1CN2CCC[C@@H](C2)[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C24H33N3O/c1-2-28-24-13-7-6-9-21(24)19-25-14-8-12-23(20-25)27-17-15-26(16-18-27)22-10-4-3-5-11-22/h3-7,9-11,13,23H,2,8,12,14-20H2,1H3/p+1/t23-/m0/s1