N-methoxy-2-[2-(2-methylphenyl)ethanoylamino]oxy-4-(thiophen-3-ylmethoxy)benzonitrilium

Systemtic Name: N-methoxy-2-[2-(2-methylphenyl)ethanoylamino]oxy-4-(thiophen-3-ylmethoxy)benzonitrilium Openeye Name: N-methoxy-2-[[2-(o-tolyl)acetyl]amino]oxy-4-(3-thienylmethoxy)benzonitrilium CAS Name: N-methoxy-2-[[2-(2-methylphenyl)-1-oxoethyl]amino]oxy-4-(3-thiophenylmethoxy)benzonitrilium IUPAC Name: N-methoxy-2-[[2-(2-methylphenyl)acetyl]amino]oxy-4-(thiophen-3-ylmethoxy)benzonitrilium Traditional Name: N-methoxy-2-[[2-(o-tolyl)acetyl]amino]oxy-4-(3-thenyloxy)benzonitrilium Formula: C22H21N2O4S+ MolecularWeight: 409.47814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)NOC2=C(C=CC(=C2)OCC3=CSC=C3)C#[N+]OC

Isomeric SMILES

CC1=CC=CC=C1CC(=O)NOC2=C(C=CC(=C2)OCC3=CSC=C3)C#[N+]OC

InChI

InChI=1S/C22H20N2O4S/c1-16-5-3-4-6-18(16)11-22(25)24-28-21-12-20(8-7-19(21)13-23-26-2)27-14-17-9-10-29-15-17/h3-10,12,15H,11,14H2,1-2H3/p+1