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

Systemtic Name: [4-[[4,5-dimethoxy-2-(pentanoylamino)phenyl]amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-[4,5-dimethoxy-2-(pentanoylamino)anilino]-4-oxo-butyl]ammonium CAS Name: [4-[4,5-dimethoxy-2-(1-oxopentylamino)anilino]-4-oxobutyl]ammonium IUPAC Name: [4-[4,5-dimethoxy-2-(pentanoylamino)anilino]-4-oxobutyl]azanium Traditional Name: [4-[4,5-dimethoxy-2-(valerylamino)anilino]-4-keto-butyl]ammonium Formula: C17H28N3O4+ MolecularWeight: 338.42192

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC(=C(C=C1NC(=O)CCC[NH3+])OC)OC

Isomeric SMILES

CCCCC(=O)NC1=CC(=C(C=C1NC(=O)CCC[NH3+])OC)OC

InChI

InChI=1S/C17H27N3O4/c1-4-5-7-16(21)19-12-10-14(23-2)15(24-3)11-13(12)20-17(22)8-6-9-18/h10-11H,4-9,18H2,1-3H3,(H,19,21)(H,20,22)/p+1