1-[(2S)-butan-2-yl]-4-(2-chloroethyl)piperazine-1,4-diium

Systemtic Name: 1-[(2S)-butan-2-yl]-4-(2-chloroethyl)piperazine-1,4-diium Openeye Name: 1-(2-chloroethyl)-4-[(1S)-1-methylpropyl]piperazine-1,4-diium CAS Name: 1-[(2S)-butan-2-yl]-4-(2-chloroethyl)piperazine-1,4-diium IUPAC Name: 1-[(2S)-butan-2-yl]-4-(2-chloroethyl)piperazine-1,4-diium Traditional Name: 1-(2-chloroethyl)-4-[(1S)-1-methylpropyl]piperazine-1,4-diium Formula: C10H23ClN2+2 MolecularWeight: 206.75602

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH+]1CC[NH+](CC1)CCCl

Isomeric SMILES

CC[C@H](C)[NH+]1CC[NH+](CC1)CCCl

InChI

InChI=1S/C10H21ClN2/c1-3-10(2)13-8-6-12(5-4-11)7-9-13/h10H,3-9H2,1-2H3/p+2/t10-/m0/s1