N-[(2S)-2-(4-dimethylaminophenyl)-2-morpholin-4-ium-4-yl-ethyl]-2-ethoxy-ethanamide

Systemtic Name: N-[(2S)-2-(4-dimethylaminophenyl)-2-morpholin-4-ium-4-yl-ethyl]-2-ethoxy-ethanamide Openeye Name: N-[(2S)-2-(4-dimethylaminophenyl)-2-morpholin-4-ium-4-yl-ethyl]-2-ethoxy-acetamide CAS Name: N-[(2S)-2-(4-dimethylaminophenyl)-2-(4-morpholin-4-iumyl)ethyl]-2-ethoxyacetamide IUPAC Name: N-[(2S)-2-(4-dimethylaminophenyl)-2-morpholin-4-ium-4-ylethyl]-2-ethoxyacetamide Traditional Name: N-[(2S)-2-(4-dimethylaminophenyl)-2-morpholin-4-ium-4-yl-ethyl]-2-ethoxy-acetamide Formula: C18H30N3O3+ MolecularWeight: 336.4491

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCC(=O)NCC(C1=CC=C(C=C1)N(C)C)[NH+]2CCOCC2

Isomeric SMILES

CCOCC(=O)NC[C@H](C1=CC=C(C=C1)N(C)C)[NH+]2CCOCC2

InChI

InChI=1S/C18H29N3O3/c1-4-23-14-18(22)19-13-17(21-9-11-24-12-10-21)15-5-7-16(8-6-15)20(2)3/h5-8,17H,4,9-14H2,1-3H3,(H,19,22)/p+1/t17-/m1/s1