N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]-2-[(5S,7R)-3-oxidanyl-1-adamantyl]ethanamide

Systemtic Name: N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]-2-[(5S,7R)-3-oxidanyl-1-adamantyl]ethanamide Openeye Name: 2-[(5S,7R)-3-hydroxy-1-adamantyl]-N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]acetamide CAS Name: 2-[(5S,7R)-3-hydroxy-1-adamantyl]-N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]acetamide IUPAC Name: 2-[(5S,7R)-3-hydroxy-1-adamantyl]-N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]acetamide Traditional Name: 2-[(5S,7R)-3-hydroxy-1-adamantyl]-N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]acetamide Formula: C21H28N2O4 MolecularWeight: 372.45802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])N(C)C(=O)CC23CC4CC(C2)CC(C4)(C3)O

Isomeric SMILES

C[C@H](C1=CC(=CC=C1)[N+](=O)[O-])N(C)C(=O)CC23C[C@H]4C[C@@H](C2)CC(C4)(C3)O

InChI

InChI=1S/C21H28N2O4/c1-14(17-4-3-5-18(7-17)23(26)27)22(2)19(24)12-20-8-15-6-16(9-20)11-21(25,10-15)13-20/h3-5,7,14-16,25H,6,8-13H2,1-2H3/t14-,15-,16+,20?,21?/m1/s1