[2-[[2-methyl-5-(pentanoylamino)phenyl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-[[2-methyl-5-(pentanoylamino)phenyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[2-methyl-5-(pentanoylamino)anilino]-2-oxo-ethyl]ammonium CAS Name: [2-[2-methyl-5-(1-oxopentylamino)anilino]-2-oxoethyl]ammonium IUPAC Name: [2-[2-methyl-5-(pentanoylamino)anilino]-2-oxoethyl]azanium Traditional Name: [2-keto-2-[2-methyl-5-(valerylamino)anilino]ethyl]ammonium Formula: C14H22N3O2+ MolecularWeight: 264.34338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC(=C(C=C1)C)NC(=O)C[NH3+]

Isomeric SMILES

CCCCC(=O)NC1=CC(=C(C=C1)C)NC(=O)C[NH3+]

InChI

InChI=1S/C14H21N3O2/c1-3-4-5-13(18)16-11-7-6-10(2)12(8-11)17-14(19)9-15/h6-8H,3-5,9,15H2,1-2H3,(H,16,18)(H,17,19)/p+1