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(3S)-3-azaniumyl-3-(4-cyanophenyl)propanoate

(3S)-3-azaniumyl-3-(4-cyanophenyl)propanoate

Systemtic Name:(3S)-3-azaniumyl-3-(4-cyanophenyl)propanoate
Openeye Name:(3S)-3-azaniumyl-3-(4-cyanophenyl)propanoate
CAS Name:(3S)-3-ammonio-3-(4-cyanophenyl)propanoate
IUPAC Name:(3S)-3-azaniumyl-3-(4-cyanophenyl)propanoate
Traditional Name:(3S)-3-ammonio-3-(4-cyanophenyl)propionate
Formula: C10H10N2O2
MolecularWeight: 190.1986
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(CC(=O)[O-])[NH3+]


Isomeric SMILES

C1=CC(=CC=C1C#N)[C@H](CC(=O)[O-])[NH3+]


InChI

InChI=1S/C10H10N2O2/c11-6-7-1-3-8(4-2-7)9(12)5-10(13)14/h1-4,9H,5,12H2,(H,13,14)/t9-/m0/s1


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