O1-tert-butyl O5-methyl (2R)-2-[7-[(3,5-dimethoxyphenyl)methoxy]-1,1-bis(oxidanylidene)-4,5-dihydro-3H-1$l^{6},2,5-benzothiadiazepin-2-yl]pentanedioate

Systemtic Name: O1-tert-butyl O5-methyl (2R)-2-[7-[(3,5-dimethoxyphenyl)methoxy]-1,1-bis(oxidanylidene)-4,5-dihydro-3H-1$l^{6},2,5-benzothiadiazepin-2-yl]pentanedioate Openeye Name: O1-tert-butyl O5-methyl (2R)-2-[7-[(3,5-dimethoxyphenyl)methoxy]-1,1-dioxo-4,5-dihydro-3H-1$l^{6},2,5-benzothiadiazepin-2-yl]pentanedioate CAS Name: (2R)-2-[7-[(3,5-dimethoxyphenyl)methoxy]-1,1-dioxo-4,5-dihydro-3H-1$l^{6},2,5-benzothiadiazepin-2-yl]pentanedioic acid O1-tert-butyl ester O5-methyl ester IUPAC Name: 1-O-tert-butyl 5-O-methyl (2R)-2-[7-[(3,5-dimethoxyphenyl)methoxy]-1,1-dioxo-4,5-dihydro-3H-1$l^{6},2,5-benzothiadiazepin-2-yl]pentanedioate Traditional Name: (2R)-2-[7-(3,5-dimethoxybenzyl)oxy-1,1-diketo-4,5-dihydro-3H-1$l^{6},2,5-benzothiadiazepin-2-yl]glutaric acid O1-tert-butyl ester O5-methyl ester Formula: C27H36N2O9S MolecularWeight: 564.64774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCC(=O)OC)N1CCNC2=C(S1(=O)=O)C=CC(=C2)OCC3=CC(=CC(=C3)OC)OC

Isomeric SMILES

CC(C)(C)OC(=O)[C@@H](CCC(=O)OC)N1CCNC2=C(S1(=O)=O)C=CC(=C2)OCC3=CC(=CC(=C3)OC)OC

InChI

InChI=1S/C27H36N2O9S/c1-27(2,3)38-26(31)23(8-10-25(30)36-6)29-12-11-28-22-16-19(7-9-24(22)39(29,32)33)37-17-18-13-20(34-4)15-21(14-18)35-5/h7,9,13-16,23,28H,8,10-12,17H2,1-6H3/t23-/m1/s1