(4-methoxyphenyl)methyl-methyl-[2-oxidanylidene-2-[(4-propoxycarbonylphenyl)amino]ethyl]azanium

Systemtic Name: (4-methoxyphenyl)methyl-methyl-[2-oxidanylidene-2-[(4-propoxycarbonylphenyl)amino]ethyl]azanium Openeye Name: (4-methoxyphenyl)methyl-methyl-[2-oxo-2-(4-propoxycarbonylanilino)ethyl]ammonium CAS Name: (4-methoxyphenyl)methyl-methyl-[2-oxo-2-[4-[oxo(propoxy)methyl]anilino]ethyl]ammonium IUPAC Name: (4-methoxyphenyl)methyl-methyl-[2-oxo-2-(4-propoxycarbonylanilino)ethyl]azanium Traditional Name: [2-keto-2-(4-propoxycarbonylanilino)ethyl]-methyl-p-anisyl-ammonium Formula: C21H27N2O4+ MolecularWeight: 371.45008

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C[NH+](C)CC2=CC=C(C=C2)OC

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C[NH+](C)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C21H26N2O4/c1-4-13-27-21(25)17-7-9-18(10-8-17)22-20(24)15-23(2)14-16-5-11-19(26-3)12-6-16/h5-12H,4,13-15H2,1-3H3,(H,22,24)/p+1