2-adamantyl N-[(2R)-3-(1H-indol-3-yl)-1-[[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]amino]-2-methyl-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: 2-adamantyl N-[(2R)-3-(1H-indol-3-yl)-1-[[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]amino]-2-methyl-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: 2-adamantyl N-[(1R)-1-(1H-indol-3-ylmethyl)-2-[[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]amino]-1-methyl-2-oxo-ethyl]carbamate CAS Name: N-[(2R)-3-(1H-indol-3-yl)-1-[[(2R)-2-(methoxymethyl)-1-pyrrolidinyl]amino]-2-methyl-1-oxopropan-2-yl]carbamic acid 2-adamantyl ester IUPAC Name: 2-adamantyl N-[(2R)-3-(1H-indol-3-yl)-1-[[(2R)-2-(methoxymethyl)pyrrolidin-1-yl]amino]-2-methyl-1-oxopropan-2-yl]carbamate Traditional Name: N-[(1R)-1-(1H-indol-3-ylmethyl)-2-keto-2-[[(2R)-2-(methoxymethyl)pyrrolidino]amino]-1-methyl-ethyl]carbamic acid 2-adamantyl ester Formula: C29H40N4O4 MolecularWeight: 508.6523

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=CC=CC=C21)(C(=O)NN3CCCC3COC)NC(=O)OC4C5CC6CC(C5)CC4C6

Isomeric SMILES

C[C@@](CC1=CNC2=CC=CC=C21)(C(=O)NN3CCC[C@@H]3COC)NC(=O)OC4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C29H40N4O4/c1-29(15-22-16-30-25-8-4-3-7-24(22)25,27(34)32-33-9-5-6-23(33)17-36-2)31-28(35)37-26-20-11-18-10-19(13-20)14-21(26)12-18/h3-4,7-8,16,18-21,23,26,30H,5-6,9-15,17H2,1-2H3,(H,31,35)(H,32,34)/t18?,19?,20?,21?,23-,26?,29-/m1/s1