ethyl 2-[3,9,12-tris(2-ethoxy-2-oxidanylidene-ethyl)-15,16,17,18-tetramethyl-3,6,9,12-tetrazabicyclo[12.2.2]octadeca-1(16),14,17-trien-6-yl]ethanoate

Systemtic Name: ethyl 2-[3,9,12-tris(2-ethoxy-2-oxidanylidene-ethyl)-15,16,17,18-tetramethyl-3,6,9,12-tetrazabicyclo[12.2.2]octadeca-1(16),14,17-trien-6-yl]ethanoate Openeye Name: ethyl 2-[3,9,12-tris(2-ethoxy-2-oxo-ethyl)-15,16,17,18-tetramethyl-3,6,9,12-tetrazabicyclo[12.2.2]octadeca-1(16),14,17-trien-6-yl]acetate CAS Name: 2-[3,9,12-tris(2-ethoxy-2-oxoethyl)-15,16,17,18-tetramethyl-3,6,9,12-tetrazabicyclo[12.2.2]octadeca-1(16),14,17-trien-6-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3,9,12-tris(2-ethoxy-2-oxoethyl)-15,16,17,18-tetramethyl-3,6,9,12-tetrazabicyclo[12.2.2]octadeca-1(16),14,17-trien-6-yl]acetate Traditional Name: 2-[3,9,12-tris(2-ethoxy-2-keto-ethyl)-15,16,17,18-tetramethyl-3,6,9,12-tetrazabicyclo[12.2.2]octadeca-1(16),14,17-trien-6-yl]acetic acid ethyl ester Formula: C34H56N4O8 MolecularWeight: 648.83044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCN(CCN(CC2=C(C(=C(CN(CC1)CC(=O)OCC)C(=C2C)C)C)C)CC(=O)OCC)CC(=O)OCC

Isomeric SMILES

CCOC(=O)CN1CCN(CCN(CC2=C(C(=C(CN(CC1)CC(=O)OCC)C(=C2C)C)C)C)CC(=O)OCC)CC(=O)OCC

InChI

InChI=1S/C34H56N4O8/c1-9-43-31(39)21-35-13-14-36(22-32(40)44-10-2)16-18-38(24-34(42)46-12-4)20-30-27(7)25(5)29(26(6)28(30)8)19-37(17-15-35)23-33(41)45-11-3/h9-24H2,1-8H3