[2-methoxy-4-[(E)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]phenyl] adamantane-1-carboxylate

Systemtic Name: [2-methoxy-4-[(E)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]phenyl] adamantane-1-carboxylate Openeye Name: [2-methoxy-4-[(E)-2-(3-methyl-4-nitro-isoxazol-5-yl)vinyl]phenyl] adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [2-methoxy-4-[(E)-2-(3-methyl-4-nitro-5-isoxazolyl)ethenyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]phenyl] adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid [2-methoxy-4-[(E)-2-(3-methyl-4-nitro-isoxazol-5-yl)vinyl]phenyl] ester Formula: C24H26N2O6 MolecularWeight: 438.47304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1[N+](=O)[O-])C=CC2=CC(=C(C=C2)OC(=O)C34CC5CC(C3)CC(C5)C4)OC

Isomeric SMILES

CC1=NOC(=C1[N+](=O)[O-])/C=C/C2=CC(=C(C=C2)OC(=O)C34CC5CC(C3)CC(C5)C4)OC

InChI

InChI=1S/C24H26N2O6/c1-14-22(26(28)29)20(32-25-14)6-4-15-3-5-19(21(10-15)30-2)31-23(27)24-11-16-7-17(12-24)9-18(8-16)13-24/h3-6,10,16-18H,7-9,11-13H2,1-2H3/b6-4+