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

Systemtic Name: 2-adamantyl N-[3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-1-(3-phenylpropylamino)propan-2-yl]carbamate Openeye Name: 2-adamantyl N-[1-(1H-indol-3-ylmethyl)-1-methyl-2-oxo-2-(3-phenylpropylamino)ethyl]carbamate CAS Name: N-[3-(1H-indol-3-yl)-2-methyl-1-oxo-1-(3-phenylpropylamino)propan-2-yl]carbamic acid 2-adamantyl ester IUPAC Name: 2-adamantyl N-[3-(1H-indol-3-yl)-2-methyl-1-oxo-1-(3-phenylpropylamino)propan-2-yl]carbamate Traditional Name: N-[1-(1H-indol-3-ylmethyl)-2-keto-1-methyl-2-(3-phenylpropylamino)ethyl]carbamic acid 2-adamantyl ester Formula: C32H39N3O3 MolecularWeight: 513.67036

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=CC=CC=C21)(C(=O)NCCCC3=CC=CC=C3)NC(=O)OC4C5CC6CC(C5)CC4C6

Isomeric SMILES

CC(CC1=CNC2=CC=CC=C21)(C(=O)NCCCC3=CC=CC=C3)NC(=O)OC4C5CC6CC(C5)CC4C6

InChI

InChI=1S/C32H39N3O3/c1-32(19-26-20-34-28-12-6-5-11-27(26)28,30(36)33-13-7-10-21-8-3-2-4-9-21)35-31(37)38-29-24-15-22-14-23(17-24)18-25(29)16-22/h2-6,8-9,11-12,20,22-25,29,34H,7,10,13-19H2,1H3,(H,33,36)(H,35,37)