methyl 3-[[(3aS,4R,8R,8aS)-2,2-dimethyl-6-oxidanylidene-4,8-bis(phenylmethyl)-5-[[1-(2-trimethylsilylethoxymethyl)indazol-5-yl]methyl]-3a,4,8,8a-tetrahydro-[1,3]dioxolo[4,5-e][1,3]diazepin-7-yl]methyl]benzoate

Systemtic Name: methyl 3-[[(3aS,4R,8R,8aS)-2,2-dimethyl-6-oxidanylidene-4,8-bis(phenylmethyl)-5-[[1-(2-trimethylsilylethoxymethyl)indazol-5-yl]methyl]-3a,4,8,8a-tetrahydro-[1,3]dioxolo[4,5-e][1,3]diazepin-7-yl]methyl]benzoate Openeye Name: methyl 3-[[(3aS,4R,8R,8aS)-4,8-dibenzyl-2,2-dimethyl-6-oxo-5-[[1-(2-trimethylsilylethoxymethyl)indazol-5-yl]methyl]-3a,4,8,8a-tetrahydro-[1,3]dioxolo[4,5-e][1,3]diazepin-7-yl]methyl]benzoate CAS Name: 3-[[(3aS,4R,8R,8aS)-2,2-dimethyl-6-oxo-4,8-bis(phenylmethyl)-5-[[1-(2-trimethylsilylethoxymethyl)-5-indazolyl]methyl]-3a,4,8,8a-tetrahydro-[1,3]dioxolo[4,5-e][1,3]diazepin-7-yl]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[(3aS,4R,8R,8aS)-4,8-dibenzyl-2,2-dimethyl-6-oxo-5-[[1-(2-trimethylsilylethoxymethyl)indazol-5-yl]methyl]-3a,4,8,8a-tetrahydro-[1,3]dioxolo[4,5-e][1,3]diazepin-7-yl]methyl]benzoate Traditional Name: 3-[[(3aS,4R,8R,8aS)-4,8-dibenzyl-6-keto-2,2-dimethyl-5-[[1-(2-trimethylsilylethoxymethyl)indazol-5-yl]methyl]-3a,4,8,8a-tetrahydro-[1,3]dioxolo[4,5-e][1,3]diazepin-7-yl]methyl]benzoic acid methyl ester Formula: C45H54N4O6Si MolecularWeight: 775.01896

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2C(N(C(=O)N(C(C2O1)CC3=CC=CC=C3)CC4=CC=CC(=C4)C(=O)OC)CC5=CC6=C(C=C5)N(N=C6)COCC[Si](C)(C)C)CC7=CC=CC=C7)C

Isomeric SMILES

CC1(O[C@H]2[C@H](N(C(=O)N([C@@H]([C@@H]2O1)CC3=CC=CC=C3)CC4=CC=CC(=C4)C(=O)OC)CC5=CC6=C(C=C5)N(N=C6)COCC[Si](C)(C)C)CC7=CC=CC=C7)C

InChI

InChI=1S/C45H54N4O6Si/c1-45(2)54-41-39(26-32-14-9-7-10-15-32)47(29-34-18-13-19-36(24-34)43(50)52-3)44(51)48(40(42(41)55-45)27-33-16-11-8-12-17-33)30-35-20-21-38-37(25-35)28-46-49(38)31-53-22-23-56(4,5)6/h7-21,24-25,28,39-42H,22-23,26-27,29-31H2,1-6H3/t39-,40-,41+,42+/m1/s1