methyl 2-[1,1-bis(oxidanylidene)-7-propan-2-yl-3,6-dihydro-1,2,7-thiadiazepin-2-yl]propanoate

Systemtic Name: methyl 2-[1,1-bis(oxidanylidene)-7-propan-2-yl-3,6-dihydro-1,2,7-thiadiazepin-2-yl]propanoate Openeye Name: methyl 2-(7-isopropyl-1,1-dioxo-3,6-dihydro-1,2,7-thiadiazepin-2-yl)propanoate CAS Name: 2-(1,1-dioxo-7-propan-2-yl-3,6-dihydro-1,2,7-thiadiazepin-2-yl)propanoic acid methyl ester IUPAC Name: methyl 2-(1,1-dioxo-7-propan-2-yl-3,6-dihydro-1,2,7-thiadiazepin-2-yl)propanoate Traditional Name: 2-(7-isopropyl-1,1-diketo-3,6-dihydro-1,2,7-thiadiazepin-2-yl)propionic acid methyl ester Formula: C11H20N2O4S MolecularWeight: 276.3525

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CC=CCN(S1(=O)=O)C(C)C(=O)OC

Isomeric SMILES

CC(C)N1CC=CCN(S1(=O)=O)C(C)C(=O)OC

InChI

InChI=1S/C11H20N2O4S/c1-9(2)12-7-5-6-8-13(18(12,15)16)10(3)11(14)17-4/h5-6,9-10H,7-8H2,1-4H3