[4-(ethylcarbamoyl)-2-nitro-phenyl] adamantane-1-carboxylate

Systemtic Name: [4-(ethylcarbamoyl)-2-nitro-phenyl] adamantane-1-carboxylate Openeye Name: [4-(ethylcarbamoyl)-2-nitro-phenyl] adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [4-(ethylcarbamoyl)-2-nitrophenyl] ester IUPAC Name: [4-(ethylcarbamoyl)-2-nitrophenyl] adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid [4-(ethylcarbamoyl)-2-nitro-phenyl] ester Formula: C20H24N2O5 MolecularWeight: 372.41496

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=C(C=C1)OC(=O)C23CC4CC(C2)CC(C4)C3)[N+](=O)[O-]

Isomeric SMILES

CCNC(=O)C1=CC(=C(C=C1)OC(=O)C23CC4CC(C2)CC(C4)C3)[N+](=O)[O-]

InChI

InChI=1S/C20H24N2O5/c1-2-21-18(23)15-3-4-17(16(8-15)22(25)26)27-19(24)20-9-12-5-13(10-20)7-14(6-12)11-20/h3-4,8,12-14H,2,5-7,9-11H2,1H3,(H,21,23)