1-[(2S)-2-morpholin-4-ium-4-yl-2-[(3R)-oxolan-3-yl]ethyl]-3-(4-nitrophenyl)urea

Systemtic Name: 1-[(2S)-2-morpholin-4-ium-4-yl-2-[(3R)-oxolan-3-yl]ethyl]-3-(4-nitrophenyl)urea Openeye Name: 1-[(2S)-2-morpholin-4-ium-4-yl-2-[(3R)-tetrahydrofuran-3-yl]ethyl]-3-(4-nitrophenyl)urea CAS Name: 1-[(2S)-2-(4-morpholin-4-iumyl)-2-[(3R)-3-oxolanyl]ethyl]-3-(4-nitrophenyl)urea IUPAC Name: 1-[(2S)-2-morpholin-4-ium-4-yl-2-[(3R)-oxolan-3-yl]ethyl]-3-(4-nitrophenyl)urea Traditional Name: 1-[(2S)-2-morpholin-4-ium-4-yl-2-[(3R)-tetrahydrofuran-3-yl]ethyl]-3-(4-nitrophenyl)urea Formula: C17H25N4O5+ MolecularWeight: 365.4042

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC1C(CNC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])[NH+]3CCOCC3

Isomeric SMILES

C1COC[C@H]1[C@@H](CNC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])[NH+]3CCOCC3

InChI

InChI=1S/C17H24N4O5/c22-17(19-14-1-3-15(4-2-14)21(23)24)18-11-16(13-5-8-26-12-13)20-6-9-25-10-7-20/h1-4,13,16H,5-12H2,(H2,18,19,22)/p+1/t13-,16+/m0/s1