[6-[(2-methylpropan-2-yl)oxycarbonylamino]-7-oxidanylidene-azepan-3-yl] 2-undecoxyethanoate

Systemtic Name: [6-[(2-methylpropan-2-yl)oxycarbonylamino]-7-oxidanylidene-azepan-3-yl] 2-undecoxyethanoate Openeye Name: [6-(tert-butoxycarbonylamino)-7-oxo-azepan-3-yl] 2-undecoxyacetate CAS Name: 2-undecoxyacetic acid [6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-7-oxo-3-azepanyl] ester IUPAC Name: [6-[(2-methylpropan-2-yl)oxycarbonylamino]-7-oxoazepan-3-yl] 2-undecoxyacetate Traditional Name: 2-undecoxyacetic acid [6-(tert-butoxycarbonylamino)-7-keto-azepan-3-yl] ester Formula: C24H44N2O6 MolecularWeight: 456.61596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOCC(=O)OC1CCC(C(=O)NC1)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCOCC(=O)OC1CCC(C(=O)NC1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C24H44N2O6/c1-5-6-7-8-9-10-11-12-13-16-30-18-21(27)31-19-14-15-20(22(28)25-17-19)26-23(29)32-24(2,3)4/h19-20H,5-18H2,1-4H3,(H,25,28)(H,26,29)