[4-[[2-ethyl-5-[(3-methylphenyl)carbonylamino]phenyl]amino]-4-oxidanylidene-butyl]azanium

Systemtic Name: [4-[[2-ethyl-5-[(3-methylphenyl)carbonylamino]phenyl]amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-[2-ethyl-5-[(3-methylbenzoyl)amino]anilino]-4-oxo-butyl]ammonium CAS Name: [4-[2-ethyl-5-[[(3-methylphenyl)-oxomethyl]amino]anilino]-4-oxobutyl]ammonium IUPAC Name: [4-[2-ethyl-5-[(3-methylbenzoyl)amino]anilino]-4-oxobutyl]azanium Traditional Name: [4-[2-ethyl-5-(m-toluoylamino)anilino]-4-keto-butyl]ammonium Formula: C20H26N3O2+ MolecularWeight: 340.43934

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)C)NC(=O)CCC[NH3+]

Isomeric SMILES

CCC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)C)NC(=O)CCC[NH3+]

InChI

InChI=1S/C20H25N3O2/c1-3-15-9-10-17(13-18(15)23-19(24)8-5-11-21)22-20(25)16-7-4-6-14(2)12-16/h4,6-7,9-10,12-13H,3,5,8,11,21H2,1-2H3,(H,22,25)(H,23,24)/p+1