N-[(1R,2R)-1,2-dicyclohexyl-2-oxidanyl-ethyl]-4-nitro-benzamide

Systemtic Name: N-[(1R,2R)-1,2-dicyclohexyl-2-oxidanyl-ethyl]-4-nitro-benzamide Openeye Name: N-[(1R,2R)-1,2-dicyclohexyl-2-hydroxy-ethyl]-4-nitro-benzamide CAS Name: N-[(1R,2R)-1,2-dicyclohexyl-2-hydroxyethyl]-4-nitrobenzamide IUPAC Name: N-[(1R,2R)-1,2-dicyclohexyl-2-hydroxyethyl]-4-nitrobenzamide Traditional Name: N-[(1R,2R)-1,2-dicyclohexyl-2-hydroxy-ethyl]-4-nitro-benzamide Formula: C21H30N2O4 MolecularWeight: 374.4739

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C(C2CCCCC2)O)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)[C@H]([C@@H](C2CCCCC2)O)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H30N2O4/c24-20(16-9-5-2-6-10-16)19(15-7-3-1-4-8-15)22-21(25)17-11-13-18(14-12-17)23(26)27/h11-16,19-20,24H,1-10H2,(H,22,25)/t19-,20-/m1/s1