2-(3-morpholin-4-ium-4-ylpropyl)-1,3-bis(oxidanylidene)-N-phenylmethoxy-isoindole-5-carboxamide

Systemtic Name: 2-(3-morpholin-4-ium-4-ylpropyl)-1,3-bis(oxidanylidene)-N-phenylmethoxy-isoindole-5-carboxamide Openeye Name: N-benzyloxy-2-(3-morpholin-4-ium-4-ylpropyl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-[3-(4-morpholin-4-iumyl)propyl]-1,3-dioxo-N-phenylmethoxy-5-isoindolecarboxamide IUPAC Name: 2-(3-morpholin-4-ium-4-ylpropyl)-1,3-dioxo-N-phenylmethoxyisoindole-5-carboxamide Traditional Name: N-benzoxy-1,3-diketo-2-(3-morpholin-4-ium-4-ylpropyl)isoindoline-5-carboxamide Formula: C23H26N3O5+ MolecularWeight: 424.46964

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NOCC4=CC=CC=C4

Isomeric SMILES

C1COCC[NH+]1CCCN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NOCC4=CC=CC=C4

InChI

InChI=1S/C23H25N3O5/c27-21(24-31-16-17-5-2-1-3-6-17)18-7-8-19-20(15-18)23(29)26(22(19)28)10-4-9-25-11-13-30-14-12-25/h1-3,5-8,15H,4,9-14,16H2,(H,24,27)/p+1