3-(4-methylpiperazin-4-ium-1-yl)propyl-[(2S)-2-phenylpropyl]azanium

Systemtic Name: 3-(4-methylpiperazin-4-ium-1-yl)propyl-[(2S)-2-phenylpropyl]azanium Openeye Name: 3-(4-methylpiperazin-4-ium-1-yl)propyl-[(2S)-2-phenylpropyl]ammonium CAS Name: 3-(4-methyl-1-piperazin-4-iumyl)propyl-[(2S)-2-phenylpropyl]ammonium IUPAC Name: 3-(4-methylpiperazin-4-ium-1-yl)propyl-[(2S)-2-phenylpropyl]azanium Traditional Name: 3-(4-methylpiperazin-4-ium-1-yl)propyl-[(2S)-2-phenylpropyl]ammonium Formula: C17H31N3+2 MolecularWeight: 277.44814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH2+]CCCN1CC[NH+](CC1)C)C2=CC=CC=C2

Isomeric SMILES

C[C@H](C[NH2+]CCCN1CC[NH+](CC1)C)C2=CC=CC=C2

InChI

InChI=1S/C17H29N3/c1-16(17-7-4-3-5-8-17)15-18-9-6-10-20-13-11-19(2)12-14-20/h3-5,7-8,16,18H,6,9-15H2,1-2H3/p+2/t16-/m1/s1