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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)[NH2+]CCCN2CC[NH+](CC2)C

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)[NH2+]CCCN2CC[NH+](CC2)C

InChI

InChI=1S/C17H29N3/c1-3-17(16-8-5-4-6-9-16)18-10-7-11-20-14-12-19(2)13-15-20/h4-6,8-9,17-18H,3,7,10-15H2,1-2H3/p+2/t17-/m0/s1