[(2S)-2-cyanopropyl]-(phenylmethyl)-propan-2-yl-azanium

Systemtic Name: [(2S)-2-cyanopropyl]-(phenylmethyl)-propan-2-yl-azanium Openeye Name: benzyl-[(2S)-2-cyanopropyl]-isopropyl-ammonium CAS Name: [(2S)-2-cyanopropyl]-(phenylmethyl)-propan-2-ylammonium IUPAC Name: benzyl-[(2S)-2-cyanopropyl]-propan-2-ylazanium Traditional Name: benzyl-[(2S)-2-cyanopropyl]-isopropyl-ammonium Formula: C14H21N2+ MolecularWeight: 217.32994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CC1=CC=CC=C1)CC(C)C#N

Isomeric SMILES

C[C@@H](C[NH+](CC1=CC=CC=C1)C(C)C)C#N

InChI

InChI=1S/C14H20N2/c1-12(2)16(10-13(3)9-15)11-14-7-5-4-6-8-14/h4-8,12-13H,10-11H2,1-3H3/p+1/t13-/m1/s1