(2S)-2-methyl-4-[(5-methyl-2-phenyl-1H-imidazol-4-yl)methyl]-1-propan-2-yl-piperazin-1-ium

Systemtic Name: (2S)-2-methyl-4-[(5-methyl-2-phenyl-1H-imidazol-4-yl)methyl]-1-propan-2-yl-piperazin-1-ium Openeye Name: (2S)-1-isopropyl-2-methyl-4-[(5-methyl-2-phenyl-1H-imidazol-4-yl)methyl]piperazin-1-ium CAS Name: (2S)-2-methyl-4-[(5-methyl-2-phenyl-1H-imidazol-4-yl)methyl]-1-propan-2-ylpiperazin-1-ium IUPAC Name: (2S)-2-methyl-4-[(5-methyl-2-phenyl-1H-imidazol-4-yl)methyl]-1-propan-2-ylpiperazin-1-ium Traditional Name: (2S)-1-isopropyl-2-methyl-4-[(5-methyl-2-phenyl-1H-imidazol-4-yl)methyl]piperazin-1-ium Formula: C19H29N4+ MolecularWeight: 313.46036

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC[NH+]1C(C)C)CC2=C(NC(=N2)C3=CC=CC=C3)C

Isomeric SMILES

C[C@H]1CN(CC[NH+]1C(C)C)CC2=C(NC(=N2)C3=CC=CC=C3)C

InChI

InChI=1S/C19H28N4/c1-14(2)23-11-10-22(12-15(23)3)13-18-16(4)20-19(21-18)17-8-6-5-7-9-17/h5-9,14-15H,10-13H2,1-4H3,(H,20,21)/p+1/t15-/m0/s1