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

Systemtic Name: [4-[[2-ethyl-5-(2-ethylbutanoylamino)phenyl]amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-[2-ethyl-5-(2-ethylbutanoylamino)anilino]-4-oxo-butyl]ammonium CAS Name: [4-[2-ethyl-5-[(2-ethyl-1-oxobutyl)amino]anilino]-4-oxobutyl]ammonium IUPAC Name: [4-[2-ethyl-5-(2-ethylbutanoylamino)anilino]-4-oxobutyl]azanium Traditional Name: [4-[2-ethyl-5-(2-ethylbutanoylamino)anilino]-4-keto-butyl]ammonium Formula: C18H30N3O2+ MolecularWeight: 320.4497

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)NC(=O)C(CC)CC)NC(=O)CCC[NH3+]

Isomeric SMILES

CCC1=C(C=C(C=C1)NC(=O)C(CC)CC)NC(=O)CCC[NH3+]

InChI

InChI=1S/C18H29N3O2/c1-4-13(5-2)18(23)20-15-10-9-14(6-3)16(12-15)21-17(22)8-7-11-19/h9-10,12-13H,4-8,11,19H2,1-3H3,(H,20,23)(H,21,22)/p+1