1-[(1R,2S)-2-methylcyclohexyl]-4-(3-phenylpropyl)piperazin-1-ium

Systemtic Name: 1-[(1R,2S)-2-methylcyclohexyl]-4-(3-phenylpropyl)piperazin-1-ium Openeye Name: 1-[(1R,2S)-2-methylcyclohexyl]-4-(3-phenylpropyl)piperazin-1-ium CAS Name: 1-[(1R,2S)-2-methylcyclohexyl]-4-(3-phenylpropyl)piperazin-1-ium IUPAC Name: 1-[(1R,2S)-2-methylcyclohexyl]-4-(3-phenylpropyl)piperazin-1-ium Traditional Name: 1-[(1R,2S)-2-methylcyclohexyl]-4-(3-phenylpropyl)piperazin-1-ium Formula: C20H33N2+ MolecularWeight: 301.48942

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1[NH+]2CCN(CC2)CCCC3=CC=CC=C3

Isomeric SMILES

C[C@H]1CCCC[C@H]1[NH+]2CCN(CC2)CCCC3=CC=CC=C3

InChI

InChI=1S/C20H32N2/c1-18-8-5-6-12-20(18)22-16-14-21(15-17-22)13-7-11-19-9-3-2-4-10-19/h2-4,9-10,18,20H,5-8,11-17H2,1H3/p+1/t18-,20+/m0/s1