methyl (2R)-2-(2-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)-2-methyl-propanoate

Systemtic Name: methyl (2R)-2-(2-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)-2-methyl-propanoate Openeye Name: methyl (2R)-2-(2-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)-2-methyl-propanoate CAS Name: (2R)-2-[[2-adamantyloxy(oxo)methyl]amino]-3-(1H-indol-3-yl)-2-methylpropanoic acid methyl ester IUPAC Name: methyl (2R)-2-(2-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)-2-methylpropanoate Traditional Name: (2R)-2-(2-adamantyloxycarbonylamino)-3-(1H-indol-3-yl)-2-methyl-propionic acid methyl ester Formula: C24H30N2O4 MolecularWeight: 412.498542

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=CC=CC=C21)(C(=O)OC)NC(=O)OC3C4CC5CC(C4)CC3C5

Isomeric SMILES

COC(=O)[C@@]([14CH3])(CC1=CNC2=CC=CC=C21)NC(=O)OC3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C24H30N2O4/c1-24(22(27)29-2,12-18-13-25-20-6-4-3-5-19(18)20)26-23(28)30-21-16-8-14-7-15(10-16)11-17(21)9-14/h3-6,13-17,21,25H,7-12H2,1-2H3,(H,26,28)/t14?,15?,16?,17?,21?,24-/m1/s1/i1+2