(1R,2S)-2-[(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)carbamoyl]cyclohexane-1-carboxylate

Systemtic Name: (1R,2S)-2-[(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)carbamoyl]cyclohexane-1-carboxylate Openeye Name: (1R,2S)-2-[(4-morpholino-2,1,3-benzoxadiazol-7-yl)carbamoyl]cyclohexanecarboxylate CAS Name: (1R,2S)-2-[[[4-(4-morpholinyl)-2,1,3-benzoxadiazol-7-yl]amino]-oxomethyl]-1-cyclohexanecarboxylate IUPAC Name: (1R,2S)-2-[(4-morpholin-4-yl-2,1,3-benzoxadiazol-7-yl)carbamoyl]cyclohexane-1-carboxylate Traditional Name: (1R,2S)-2-[(7-morpholinobenzofurazan-4-yl)carbamoyl]cyclohexanecarboxylate Formula: C18H21N4O5- MolecularWeight: 373.38314

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NC2=CC=C(C3=NON=C23)N4CCOCC4)C(=O)[O-]

Isomeric SMILES

C1CC[C@H]([C@H](C1)C(=O)NC2=CC=C(C3=NON=C23)N4CCOCC4)C(=O)[O-]

InChI

InChI=1S/C18H22N4O5/c23-17(11-3-1-2-4-12(11)18(24)25)19-13-5-6-14(16-15(13)20-27-21-16)22-7-9-26-10-8-22/h5-6,11-12H,1-4,7-10H2,(H,19,23)(H,24,25)/p-1/t11-,12+/m0/s1