[2-[[2-[(5-acetamido-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]amino]phenyl]methyl-cyclohexyl-methyl-azanium

Systemtic Name: [2-[[2-[(5-acetamido-2-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]amino]phenyl]methyl-cyclohexyl-methyl-azanium Openeye Name: [2-[[2-(5-acetamido-2-methoxy-anilino)-2-oxo-ethyl]amino]phenyl]methyl-cyclohexyl-methyl-ammonium CAS Name: [2-[[2-(5-acetamido-2-methoxyanilino)-2-oxoethyl]amino]phenyl]methyl-cyclohexyl-methylammonium IUPAC Name: [2-[[2-(5-acetamido-2-methoxyanilino)-2-oxoethyl]amino]phenyl]methyl-cyclohexyl-methylazanium Traditional Name: [2-[[2-(5-acetamido-2-methoxy-anilino)-2-keto-ethyl]amino]benzyl]-cyclohexyl-methyl-ammonium Formula: C25H35N4O3+ MolecularWeight: 439.5704

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)CNC2=CC=CC=C2C[NH+](C)C3CCCCC3

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)CNC2=CC=CC=C2C[NH+](C)C3CCCCC3

InChI

InChI=1S/C25H34N4O3/c1-18(30)27-20-13-14-24(32-3)23(15-20)28-25(31)16-26-22-12-8-7-9-19(22)17-29(2)21-10-5-4-6-11-21/h7-9,12-15,21,26H,4-6,10-11,16-17H2,1-3H3,(H,27,30)(H,28,31)/p+1