bis[2-[2,2,6,6-tetramethyl-4-(7-oxidanylidene-2H-azepin-1-yl)piperidin-1-yl]ethyl] hexanedioate

Systemtic Name: bis[2-[2,2,6,6-tetramethyl-4-(7-oxidanylidene-2H-azepin-1-yl)piperidin-1-yl]ethyl] hexanedioate Openeye Name: bis[2-[2,2,6,6-tetramethyl-4-(7-oxo-2H-azepin-1-yl)-1-piperidyl]ethyl] hexanedioate CAS Name: hexanedioic acid bis[2-[2,2,6,6-tetramethyl-4-(7-oxo-2H-azepin-1-yl)-1-piperidinyl]ethyl] ester IUPAC Name: bis[2-[2,2,6,6-tetramethyl-4-(7-oxo-2H-azepin-1-yl)piperidin-1-yl]ethyl] hexanedioate Traditional Name: adipic acid bis[2-[4-(7-keto-2H-azepin-1-yl)-2,2,6,6-tetramethyl-piperidino]ethyl] ester Formula: C40H62N4O6 MolecularWeight: 694.94348

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(N1CCOC(=O)CCCCC(=O)OCCN2C(CC(CC2(C)C)N3CC=CC=CC3=O)(C)C)(C)C)N4CC=CC=CC4=O)C

Isomeric SMILES

CC1(CC(CC(N1CCOC(=O)CCCCC(=O)OCCN2C(CC(CC2(C)C)N3CC=CC=CC3=O)(C)C)(C)C)N4CC=CC=CC4=O)C

InChI

InChI=1S/C40H62N4O6/c1-37(2)27-31(41-21-15-9-11-17-33(41)45)28-38(3,4)43(37)23-25-49-35(47)19-13-14-20-36(48)50-26-24-44-39(5,6)29-32(30-40(44,7)8)42-22-16-10-12-18-34(42)46/h9-12,15-18,31-32H,13-14,19-30H2,1-8H3