dimethyl-[(2S)-1-(4-morpholin-4-ylphenyl)-1-oxidanylidene-2-(phenylmethyl)butan-2-yl]azanium

Systemtic Name: dimethyl-[(2S)-1-(4-morpholin-4-ylphenyl)-1-oxidanylidene-2-(phenylmethyl)butan-2-yl]azanium Openeye Name: [(1S)-1-benzyl-1-(4-morpholinobenzoyl)propyl]-dimethyl-ammonium CAS Name: dimethyl-[(2S)-1-[4-(4-morpholinyl)phenyl]-1-oxo-2-(phenylmethyl)butan-2-yl]ammonium IUPAC Name: [(2S)-2-benzyl-1-(4-morpholin-4-ylphenyl)-1-oxobutan-2-yl]-dimethylazanium Traditional Name: [(1S)-1-benzyl-1-(4-morpholinobenzoyl)propyl]-dimethyl-ammonium Formula: C23H31N2O2+ MolecularWeight: 367.50444

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=CC=C1)(C(=O)C2=CC=C(C=C2)N3CCOCC3)[NH+](C)C

Isomeric SMILES

CC[C@](CC1=CC=CC=C1)(C(=O)C2=CC=C(C=C2)N3CCOCC3)[NH+](C)C

InChI

InChI=1S/C23H30N2O2/c1-4-23(24(2)3,18-19-8-6-5-7-9-19)22(26)20-10-12-21(13-11-20)25-14-16-27-17-15-25/h5-13H,4,14-18H2,1-3H3/p+1/t23-/m0/s1