(3,4-dimethoxyphenyl)methyl-methyl-[(1S)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl]azanium

Systemtic Name: (3,4-dimethoxyphenyl)methyl-methyl-[(1S)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl]azanium Openeye Name: (3,4-dimethoxyphenyl)methyl-methyl-[(1S)-2-morpholino-2-oxo-1-phenyl-ethyl]ammonium CAS Name: (3,4-dimethoxyphenyl)methyl-methyl-[(1S)-2-(4-morpholinyl)-2-oxo-1-phenylethyl]ammonium IUPAC Name: (3,4-dimethoxyphenyl)methyl-methyl-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]azanium Traditional Name: [(1S)-2-keto-2-morpholino-1-phenyl-ethyl]-methyl-veratryl-ammonium Formula: C22H29N2O4+ MolecularWeight: 385.47666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O4/c1-23(16-17-9-10-19(26-2)20(15-17)27-3)21(18-7-5-4-6-8-18)22(25)24-11-13-28-14-12-24/h4-10,15,21H,11-14,16H2,1-3H3/p+1/t21-/m0/s1