[4-[[2-ethyl-5-(pentanoylamino)phenyl]amino]-4-oxidanylidene-butyl]azanium

Systemtic Name: [4-[[2-ethyl-5-(pentanoylamino)phenyl]amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-[2-ethyl-5-(pentanoylamino)anilino]-4-oxo-butyl]ammonium CAS Name: [4-[2-ethyl-5-(1-oxopentylamino)anilino]-4-oxobutyl]ammonium IUPAC Name: [4-[2-ethyl-5-(pentanoylamino)anilino]-4-oxobutyl]azanium Traditional Name: [4-[2-ethyl-5-(valerylamino)anilino]-4-keto-butyl]ammonium Formula: C17H28N3O2+ MolecularWeight: 306.42312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27N3O2/c1-3-5-7-16(21)19-14-10-9-13(4-2)15(12-14)20-17(22)8-6-11-18/h9-10,12H,3-8,11,18H2,1-2H3,(H,19,21)(H,20,22)/p+1