1-(2-methoxyphenyl)-4-[(3S)-1-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]piperazine

Systemtic Name: 1-(2-methoxyphenyl)-4-[(3S)-1-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]piperazine Openeye Name: 1-(2-methoxyphenyl)-4-[(3S)-1-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]piperazine CAS Name: 1-(2-methoxyphenyl)-4-[(3S)-1-[(3-methyl-1-propyl-4-pyrazolyl)methyl]-3-piperidin-1-iumyl]piperazine IUPAC Name: 1-(2-methoxyphenyl)-4-[(3S)-1-[(3-methyl-1-propylpyrazol-4-yl)methyl]piperidin-1-ium-3-yl]piperazine Traditional Name: 1-(2-methoxyphenyl)-4-[(3S)-1-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]piperazine Formula: C24H38N5O+ MolecularWeight: 412.59142

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C(=N1)C)C[NH+]2CCCC(C2)N3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CCCN1C=C(C(=N1)C)C[NH+]2CCC[C@@H](C2)N3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C24H37N5O/c1-4-11-29-18-21(20(2)25-29)17-26-12-7-8-22(19-26)27-13-15-28(16-14-27)23-9-5-6-10-24(23)30-3/h5-6,9-10,18,22H,4,7-8,11-17,19H2,1-3H3/p+1/t22-/m0/s1