3-[2-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]ethanoylamino]-N-ethyl-benzamide

Systemtic Name: 3-[2-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]ethanoylamino]-N-ethyl-benzamide Openeye Name: 3-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]acetyl]amino]-N-ethyl-benzamide CAS Name: 3-[[2-[(2S,6S)-2,6-dimethyl-4-morpholin-4-iumyl]-1-oxoethyl]amino]-N-ethylbenzamide IUPAC Name: 3-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]acetyl]amino]-N-ethylbenzamide Traditional Name: 3-[[2-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]acetyl]amino]-N-ethyl-benzamide Formula: C17H26N3O3+ MolecularWeight: 320.40664

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=CC=C1)NC(=O)C[NH+]2CC(OC(C2)C)C

Isomeric SMILES

CCNC(=O)C1=CC(=CC=C1)NC(=O)C[NH+]2C[C@@H](O[C@H](C2)C)C

InChI

InChI=1S/C17H25N3O3/c1-4-18-17(22)14-6-5-7-15(8-14)19-16(21)11-20-9-12(2)23-13(3)10-20/h5-8,12-13H,4,9-11H2,1-3H3,(H,18,22)(H,19,21)/p+1/t12-,13-/m0/s1