[2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl] 2-(4-methanoyl-2-methoxy-phenoxy)ethanoate

Systemtic Name: [2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl] 2-(4-methanoyl-2-methoxy-phenoxy)ethanoate Openeye Name: [2-(1-adamantylmethylamino)-2-oxo-ethyl] 2-(4-formyl-2-methoxy-phenoxy)acetate CAS Name: 2-(4-formyl-2-methoxyphenoxy)acetic acid [2-(1-adamantylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylmethylamino)-2-oxoethyl] 2-(4-formyl-2-methoxyphenoxy)acetate Traditional Name: 2-(4-formyl-2-methoxy-phenoxy)acetic acid [2-(1-adamantylmethylamino)-2-keto-ethyl] ester Formula: C23H29NO6 MolecularWeight: 415.47946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=O)OCC(=O)OCC(=O)NCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC1=C(C=CC(=C1)C=O)OCC(=O)OCC(=O)NCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C23H29NO6/c1-28-20-7-15(11-25)2-3-19(20)29-13-22(27)30-12-21(26)24-14-23-8-16-4-17(9-23)6-18(5-16)10-23/h2-3,7,11,16-18H,4-6,8-10,12-14H2,1H3,(H,24,26)