2-[butanoyl-(phenylmethyl)amino]ethylazanium

Systemtic Name: 2-[butanoyl-(phenylmethyl)amino]ethylazanium Openeye Name: 2-[benzyl(butanoyl)amino]ethylammonium CAS Name: 2-[1-oxobutyl-(phenylmethyl)amino]ethylammonium IUPAC Name: 2-[benzyl(butanoyl)amino]ethylazanium Traditional Name: 2-[benzyl(butyryl)amino]ethylammonium Formula: C13H21N2O+ MolecularWeight: 221.31864

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O/c1-2-6-13(16)15(10-9-14)11-12-7-4-3-5-8-12/h3-5,7-8H,2,6,9-11,14H2,1H3/p+1