[1-(1-adamantyl)-2-methoxy-2-oxidanylidene-ethyl] 2-azanyl-3-(5-oxidanyl-1H-indol-3-yl)propanoate

Systemtic Name: [1-(1-adamantyl)-2-methoxy-2-oxidanylidene-ethyl] 2-azanyl-3-(5-oxidanyl-1H-indol-3-yl)propanoate Openeye Name: [1-(1-adamantyl)-2-methoxy-2-oxo-ethyl] 2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoate CAS Name: 2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoic acid [1-(1-adamantyl)-2-methoxy-2-oxoethyl] ester IUPAC Name: [1-(1-adamantyl)-2-methoxy-2-oxoethyl] 2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoate Traditional Name: 2-amino-3-(5-hydroxy-1H-indol-3-yl)propionic acid [1-(1-adamantyl)-2-keto-2-methoxy-ethyl] ester Formula: C24H30N2O5 MolecularWeight: 426.5054

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C12CC3CC(C1)CC(C3)C2)OC(=O)C(CC4=CNC5=C4C=C(C=C5)O)N

Isomeric SMILES

COC(=O)C(C12CC3CC(C1)CC(C3)C2)OC(=O)C(CC4=CNC5=C4C=C(C=C5)O)N

InChI

InChI=1S/C24H30N2O5/c1-30-23(29)21(24-9-13-4-14(10-24)6-15(5-13)11-24)31-22(28)19(25)7-16-12-26-20-3-2-17(27)8-18(16)20/h2-3,8,12-15,19,21,26-27H,4-7,9-11,25H2,1H3