2-adamantyl N-[(2R)-3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-1-(piperidin-1-ylamino)propan-2-yl]carbamate

Systemtic Name: 2-adamantyl N-[(2R)-3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-1-(piperidin-1-ylamino)propan-2-yl]carbamate Openeye Name: 2-adamantyl N-[(1R)-1-(1H-indol-3-ylmethyl)-1-methyl-2-oxo-2-(1-piperidylamino)ethyl]carbamate CAS Name: N-[(2R)-3-(1H-indol-3-yl)-2-methyl-1-oxo-1-(1-piperidinylamino)propan-2-yl]carbamic acid 2-adamantyl ester IUPAC Name: 2-adamantyl N-[(2R)-3-(1H-indol-3-yl)-2-methyl-1-oxo-1-(piperidin-1-ylamino)propan-2-yl]carbamate Traditional Name: N-[(1R)-1-(1H-indol-3-ylmethyl)-2-keto-1-methyl-2-(piperidinoamino)ethyl]carbamic acid 2-adamantyl ester Formula: C28H38N4O3 MolecularWeight: 478.62632

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=CC=CC=C21)(C(=O)NN3CCCCC3)NC(=O)OC4C5CC6CC(C5)CC4C6

Isomeric SMILES

C[C@@](CC1=CNC2=CC=CC=C21)(C(=O)NN3CCCCC3)NC(=O)OC4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C28H38N4O3/c1-28(26(33)31-32-9-5-2-6-10-32,16-22-17-29-24-8-4-3-7-23(22)24)30-27(34)35-25-20-12-18-11-19(14-20)15-21(25)13-18/h3-4,7-8,17-21,25,29H,2,5-6,9-16H2,1H3,(H,30,34)(H,31,33)/t18?,19?,20?,21?,25?,28-/m1/s1