2-[(phenylmethyl)-propanoyl-amino]ethylazanium

Systemtic Name: 2-[(phenylmethyl)-propanoyl-amino]ethylazanium Openeye Name: 2-[benzyl(propanoyl)amino]ethylammonium CAS Name: 2-[1-oxopropyl-(phenylmethyl)amino]ethylammonium IUPAC Name: 2-[benzyl(propanoyl)amino]ethylazanium Traditional Name: 2-[benzyl(propionyl)amino]ethylammonium Formula: C12H19N2O+ MolecularWeight: 207.29206

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(CC[NH3+])CC1=CC=CC=C1

Isomeric SMILES

CCC(=O)N(CC[NH3+])CC1=CC=CC=C1

InChI

InChI=1S/C12H18N2O/c1-2-12(15)14(9-8-13)10-11-6-4-3-5-7-11/h3-7H,2,8-10,13H2,1H3/p+1