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(2S)-2-phenyl-1,4-diazepan-4-ium

(2S)-2-phenyl-1,4-diazepan-4-ium

Systemtic Name:(2S)-2-phenyl-1,4-diazepan-4-ium
Openeye Name:(2S)-2-phenyl-1,4-diazepan-4-ium
CAS Name:(2S)-2-phenyl-1,4-diazepan-4-ium
IUPAC Name:(2S)-2-phenyl-1,4-diazepan-4-ium
Traditional Name:(2S)-2-phenyl-1,4-diazepan-4-ium
Formula: C11H17N2+
MolecularWeight: 177.26608
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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CC(NC1)C2=CC=CC=C2


Isomeric SMILES

C1C[NH2+]C[C@@H](NC1)C2=CC=CC=C2


InChI

InChI=1S/C11H16N2/c1-2-5-10(6-3-1)11-9-12-7-4-8-13-11/h1-3,5-6,11-13H,4,7-9H2/p+1/t11-/m1/s1


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