[2-oxidanylidene-2-[[2-oxidanylidene-2-(propan-2-ylamino)ethyl]amino]ethyl] (5R,7R)-3-bromanyladamantane-1-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[2-oxidanylidene-2-(propan-2-ylamino)ethyl]amino]ethyl] (5R,7R)-3-bromanyladamantane-1-carboxylate Openeye Name: [2-[[2-(isopropylamino)-2-oxo-ethyl]amino]-2-oxo-ethyl] (5R,7R)-3-bromoadamantane-1-carboxylate CAS Name: (5R,7R)-3-bromo-1-adamantanecarboxylic acid [2-oxo-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]ethyl] (5R,7R)-3-bromoadamantane-1-carboxylate Traditional Name: (5R,7R)-3-bromoadamantane-1-carboxylic acid [2-[[2-(isopropylamino)-2-keto-ethyl]amino]-2-keto-ethyl] ester Formula: C18H27BrN2O4 MolecularWeight: 415.32198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CNC(=O)COC(=O)C12CC3CC(C1)CC(C3)(C2)Br

Isomeric SMILES

CC(C)NC(=O)CNC(=O)COC(=O)C12C[C@H]3C[C@H](C1)CC(C3)(C2)Br

InChI

InChI=1S/C18H27BrN2O4/c1-11(2)21-14(22)8-20-15(23)9-25-16(24)17-4-12-3-13(5-17)7-18(19,6-12)10-17/h11-13H,3-10H2,1-2H3,(H,20,23)(H,21,22)/t12-,13-,17?,18?/m1/s1