(2-azanyl-2-oxidanylidene-ethyl)-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]azanium

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl)-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]azanium Openeye Name: (2-amino-2-oxo-ethyl)-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]ammonium CAS Name: (2-amino-2-oxoethyl)-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]ammonium IUPAC Name: (2-amino-2-oxoethyl)-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]azanium Traditional Name: (2-amino-2-keto-ethyl)-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]ammonium Formula: C13H21N3O+2 MolecularWeight: 235.32534

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC1[NH2+]CC(=O)N)CC2=CC=CC=C2

Isomeric SMILES

C1C[NH+](C[C@H]1[NH2+]CC(=O)N)CC2=CC=CC=C2

InChI

InChI=1S/C13H19N3O/c14-13(17)8-15-12-6-7-16(10-12)9-11-4-2-1-3-5-11/h1-5,12,15H,6-10H2,(H2,14,17)/p+2/t12-/m0/s1