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

Systemtic Name: [3-methoxy-4-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethoxy]phenyl]methyl-phenethyl-azanium Openeye Name: [3-methoxy-4-[2-(4-methylanilino)-2-oxo-ethoxy]phenyl]methyl-phenethyl-ammonium CAS Name: [3-methoxy-4-[2-(4-methylanilino)-2-oxoethoxy]phenyl]methyl-phenethylammonium IUPAC Name: [3-methoxy-4-[2-(4-methylanilino)-2-oxoethoxy]phenyl]methyl-phenethylazanium Traditional Name: [4-[2-keto-2-(p-toluidino)ethoxy]-3-methoxy-benzyl]-phenethyl-ammonium Formula: C25H29N2O3+ MolecularWeight: 405.50936

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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+]CCC3=CC=CC=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)C[NH2+]CCC3=CC=CC=C3)OC

InChI

InChI=1S/C25H28N2O3/c1-19-8-11-22(12-9-19)27-25(28)18-30-23-13-10-21(16-24(23)29-2)17-26-15-14-20-6-4-3-5-7-20/h3-13,16,26H,14-15,17-18H2,1-2H3,(H,27,28)/p+1