3-methyl-3-[(2-methylpropan-2-yl)oxyamino]-N-[(3R)-2-oxidanylidene-1-[[4-[2-[2-(triphenylmethyl)-1,2,3,4-tetrazol-5-yl]phenyl]cyclohexyl]methyl]-4,5-dihydro-3H-1-benzazepin-3-yl]butanamide

Systemtic Name: 3-methyl-3-[(2-methylpropan-2-yl)oxyamino]-N-[(3R)-2-oxidanylidene-1-[[4-[2-[2-(triphenylmethyl)-1,2,3,4-tetrazol-5-yl]phenyl]cyclohexyl]methyl]-4,5-dihydro-3H-1-benzazepin-3-yl]butanamide Openeye Name: 3-(tert-butoxyamino)-3-methyl-N-[(3R)-2-oxo-1-[[4-[2-(2-trityltetrazol-5-yl)phenyl]cyclohexyl]methyl]-4,5-dihydro-3H-1-benzazepin-3-yl]butanamide CAS Name: 3-methyl-3-[(2-methylpropan-2-yl)oxyamino]-N-[(3R)-2-oxo-1-[[4-[2-[2-(triphenylmethyl)-5-tetrazolyl]phenyl]cyclohexyl]methyl]-4,5-dihydro-3H-1-benzazepin-3-yl]butanamide IUPAC Name: 3-methyl-3-[(2-methylpropan-2-yl)oxyamino]-N-[(3R)-2-oxo-1-[[4-[2-(2-trityltetrazol-5-yl)phenyl]cyclohexyl]methyl]-4,5-dihydro-3H-1-benzazepin-3-yl]butanamide Traditional Name: 3-(tert-butoxyamino)-N-[(3R)-2-keto-1-[[4-[2-(2-trityltetrazol-5-yl)phenyl]cyclohexyl]methyl]-4,5-dihydro-3H-1-benzazepin-3-yl]-3-methyl-butyramide Formula: C52H59N7O3 MolecularWeight: 830.06996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)ONC(C)(C)CC(=O)NC1CCC2=CC=CC=C2N(C1=O)CC3CCC(CC3)C4=CC=CC=C4C5=NN(N=N5)C(C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8

Isomeric SMILES

CC(C)(C)ONC(C)(C)CC(=O)N[C@@H]1CCC2=CC=CC=C2N(C1=O)CC3CCC(CC3)C4=CC=CC=C4C5=NN(N=N5)C(C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8

InChI

InChI=1S/C52H59N7O3/c1-50(2,3)62-56-51(4,5)35-47(60)53-45-34-33-39-19-15-18-28-46(39)58(49(45)61)36-37-29-31-38(32-30-37)43-26-16-17-27-44(43)48-54-57-59(55-48)52(40-20-9-6-10-21-40,41-22-11-7-12-23-41)42-24-13-8-14-25-42/h6-28,37-38,45,56H,29-36H2,1-5H3,(H,53,60)/t37?,38?,45-/m1/s1