cyclopropyl-[(4-methoxyphenyl)methyl]-[(1S)-2-(methylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl]azanium

Systemtic Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[(1S)-2-(methylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl]azanium Openeye Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[(1S)-2-(methylcarbamoylamino)-2-oxo-1-phenyl-ethyl]ammonium CAS Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[(1S)-2-(methylcarbamoylamino)-2-oxo-1-phenylethyl]ammonium IUPAC Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[(1S)-2-(methylcarbamoylamino)-2-oxo-1-phenylethyl]azanium Traditional Name: cyclopropyl-[(1S)-2-keto-2-(methylcarbamoylamino)-1-phenyl-ethyl]-p-anisyl-ammonium Formula: C21H26N3O3+ MolecularWeight: 368.44944

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)C(C1=CC=CC=C1)[NH+](CC2=CC=C(C=C2)OC)C3CC3

Isomeric SMILES

CNC(=O)NC(=O)[C@H](C1=CC=CC=C1)[NH+](CC2=CC=C(C=C2)OC)C3CC3

InChI

InChI=1S/C21H25N3O3/c1-22-21(26)23-20(25)19(16-6-4-3-5-7-16)24(17-10-11-17)14-15-8-12-18(27-2)13-9-15/h3-9,12-13,17,19H,10-11,14H2,1-2H3,(H2,22,23,25,26)/p+1/t19-/m0/s1