(1S,2R)-2-[[9,10-bis(oxidanylidene)anthracen-1-yl]carbamoyl]cyclohexane-1-carboxylate

Systemtic Name: (1S,2R)-2-[[9,10-bis(oxidanylidene)anthracen-1-yl]carbamoyl]cyclohexane-1-carboxylate Openeye Name: (1S,2R)-2-[(9,10-dioxo-1-anthryl)carbamoyl]cyclohexanecarboxylate CAS Name: (1S,2R)-2-[[(9,10-dioxo-1-anthracenyl)amino]-oxomethyl]-1-cyclohexanecarboxylate IUPAC Name: (1S,2R)-2-[(9,10-dioxoanthracen-1-yl)carbamoyl]cyclohexane-1-carboxylate Traditional Name: (1S,2R)-2-[(9,10-diketo-1-anthryl)carbamoyl]cyclohexanecarboxylate Formula: C22H18NO5- MolecularWeight: 376.38202

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O)C(=O)[O-]

Isomeric SMILES

C1CC[C@@H]([C@@H](C1)C(=O)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O)C(=O)[O-]

InChI

InChI=1S/C22H19NO5/c24-19-12-6-1-2-7-13(12)20(25)18-16(19)10-5-11-17(18)23-21(26)14-8-3-4-9-15(14)22(27)28/h1-2,5-7,10-11,14-15H,3-4,8-9H2,(H,23,26)(H,27,28)/p-1/t14-,15+/m1/s1