4-ethanoyl-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-1H-pyrrole-2-carboxamide

Systemtic Name: 4-ethanoyl-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-1H-pyrrole-2-carboxamide Openeye Name: 4-acetyl-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-1H-pyrrole-2-carboxamide CAS Name: 4-acetyl-N-[(1S)-2-(4-morpholin-4-iumyl)-1-phenylethyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-acetyl-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenylethyl]-1H-pyrrole-2-carboxamide Traditional Name: 4-acetyl-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-1H-pyrrole-2-carboxamide Formula: C19H24N3O3+ MolecularWeight: 342.41216

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CNC(=C1)C(=O)NC(C[NH+]2CCOCC2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CNC(=C1)C(=O)N[C@H](C[NH+]2CCOCC2)C3=CC=CC=C3

InChI

InChI=1S/C19H23N3O3/c1-14(23)16-11-17(20-12-16)19(24)21-18(15-5-3-2-4-6-15)13-22-7-9-25-10-8-22/h2-6,11-12,18,20H,7-10,13H2,1H3,(H,21,24)/p+1/t18-/m1/s1