[(2S)-1-(4-acetamidophenyl)-1-oxidanylidene-propan-2-yl]-methyl-[(2-morpholin-4-ylphenyl)methyl]azanium

Systemtic Name: [(2S)-1-(4-acetamidophenyl)-1-oxidanylidene-propan-2-yl]-methyl-[(2-morpholin-4-ylphenyl)methyl]azanium Openeye Name: [(1S)-2-(4-acetamidophenyl)-1-methyl-2-oxo-ethyl]-methyl-[(2-morpholinophenyl)methyl]ammonium CAS Name: [(2S)-1-(4-acetamidophenyl)-1-oxopropan-2-yl]-methyl-[[2-(4-morpholinyl)phenyl]methyl]ammonium IUPAC Name: [(2S)-1-(4-acetamidophenyl)-1-oxopropan-2-yl]-methyl-[(2-morpholin-4-ylphenyl)methyl]azanium Traditional Name: [(1S)-2-(4-acetamidophenyl)-2-keto-1-methyl-ethyl]-methyl-(2-morpholinobenzyl)ammonium Formula: C23H30N3O3+ MolecularWeight: 396.5026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)NC(=O)C)[NH+](C)CC2=CC=CC=C2N3CCOCC3

Isomeric SMILES

C[C@@H](C(=O)C1=CC=C(C=C1)NC(=O)C)[NH+](C)CC2=CC=CC=C2N3CCOCC3

InChI

InChI=1S/C23H29N3O3/c1-17(23(28)19-8-10-21(11-9-19)24-18(2)27)25(3)16-20-6-4-5-7-22(20)26-12-14-29-15-13-26/h4-11,17H,12-16H2,1-3H3,(H,24,27)/p+1/t17-/m0/s1