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

Systemtic Name: 2-adamantyl N-[3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-1-(3-oxidanylidenepropylamino)propan-2-yl]carbamate Openeye Name: 2-adamantyl N-[1-(1H-indol-3-ylmethyl)-1-methyl-2-oxo-2-(3-oxopropylamino)ethyl]carbamate CAS Name: N-[3-(1H-indol-3-yl)-2-methyl-1-oxo-1-(3-oxopropylamino)propan-2-yl]carbamic acid 2-adamantyl ester IUPAC Name: 2-adamantyl N-[3-(1H-indol-3-yl)-2-methyl-1-oxo-1-(3-oxopropylamino)propan-2-yl]carbamate Traditional Name: N-[1-(1H-indol-3-ylmethyl)-2-keto-2-(3-ketopropylamino)-1-methyl-ethyl]carbamic acid 2-adamantyl ester Formula: C26H33N3O4 MolecularWeight: 451.55792

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H33N3O4/c1-26(24(31)27-7-4-8-30,14-20-15-28-22-6-3-2-5-21(20)22)29-25(32)33-23-18-10-16-9-17(12-18)13-19(23)11-16/h2-3,5-6,8,15-19,23,28H,4,7,9-14H2,1H3,(H,27,31)(H,29,32)