[3-methoxy-4-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethoxy]phenyl]methyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: [3-methoxy-4-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethoxy]phenyl]methyl-(thiophen-2-ylmethyl)azanium Openeye Name: [3-methoxy-4-[2-(4-methylanilino)-2-oxo-ethoxy]phenyl]methyl-(2-thienylmethyl)ammonium CAS Name: [3-methoxy-4-[2-(4-methylanilino)-2-oxoethoxy]phenyl]methyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: [3-methoxy-4-[2-(4-methylanilino)-2-oxoethoxy]phenyl]methyl-(thiophen-2-ylmethyl)azanium Traditional Name: [4-[2-keto-2-(p-toluidino)ethoxy]-3-methoxy-benzyl]-(2-thenyl)ammonium Formula: C22H25N2O3S+ MolecularWeight: 397.5105

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)C[NH2+]CC3=CC=CS3)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)C[NH2+]CC3=CC=CS3)OC

InChI

InChI=1S/C22H24N2O3S/c1-16-5-8-18(9-6-16)24-22(25)15-27-20-10-7-17(12-21(20)26-2)13-23-14-19-4-3-11-28-19/h3-12,23H,13-15H2,1-2H3,(H,24,25)/p+1