3-chloranyl-N2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzene-1,2-diamine

Systemtic Name: 3-chloranyl-N2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzene-1,2-diamine Openeye Name: 3-chloro-N2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzene-1,2-diamine CAS Name: 3-chloro-N2-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]benzene-1,2-diamine IUPAC Name: 3-chloro-2-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzene-1,2-diamine Traditional Name: (2-amino-6-chloro-phenyl)-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]amine Formula: C15H25ClN3+ MolecularWeight: 282.8321

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC2=C(C=CC=C2Cl)N

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNC2=C(C=CC=C2Cl)N

InChI

InChI=1S/C15H24ClN3/c1-12-6-2-3-10-19(12)11-5-9-18-15-13(16)7-4-8-14(15)17/h4,7-8,12,18H,2-3,5-6,9-11,17H2,1H3/p+1/t12-/m0/s1