2-(1-methylidene-3-oxidanylidene-isoindol-2-yl)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]ethanamide

Systemtic Name: 2-(1-methylidene-3-oxidanylidene-isoindol-2-yl)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]ethanamide Openeye Name: 2-(1-methylene-3-oxo-isoindolin-2-yl)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]acetamide CAS Name: 2-(1-methylene-3-oxo-2-isoindolyl)-N-[(1S)-2-(4-morpholin-4-iumyl)-1-phenylethyl]acetamide IUPAC Name: 2-(1-methylidene-3-oxoisoindol-2-yl)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenylethyl]acetamide Traditional Name: 2-(1-keto-3-methylene-isoindolin-2-yl)-N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]acetamide Formula: C23H26N3O3+ MolecularWeight: 392.47084

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C2=CC=CC=C2C(=O)N1CC(=O)NC(C[NH+]3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

C=C1C2=CC=CC=C2C(=O)N1CC(=O)N[C@H](C[NH+]3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3O3/c1-17-19-9-5-6-10-20(19)23(28)26(17)16-22(27)24-21(18-7-3-2-4-8-18)15-25-11-13-29-14-12-25/h2-10,21H,1,11-16H2,(H,24,27)/p+1/t21-/m1/s1