N-tert-butyl-N-[2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl]benzo[b][1]benzoxepine-5-carboxamide

Systemtic Name: N-tert-butyl-N-[2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl]benzo[b][1]benzoxepine-5-carboxamide Openeye Name: N-tert-butyl-N-[2-oxo-2-(tetrahydrofuran-2-ylmethylamino)ethyl]benzo[b][1]benzoxepine-5-carboxamide CAS Name: N-tert-butyl-N-[2-oxo-2-(2-oxolanylmethylamino)ethyl]-5-benzo[b][1]benzoxepincarboxamide IUPAC Name: N-tert-butyl-N-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]benzo[b][1]benzoxepine-5-carboxamide Traditional Name: N-tert-butyl-N-[2-keto-2-(tetrahydrofurfurylamino)ethyl]benzo[b][1]benzoxepin-5-carboxamide Formula: C26H30N2O4 MolecularWeight: 434.5274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(CC(=O)NCC1CCCO1)C(=O)C2=CC3=CC=CC=C3OC4=CC=CC=C42

Isomeric SMILES

CC(C)(C)N(CC(=O)NCC1CCCO1)C(=O)C2=CC3=CC=CC=C3OC4=CC=CC=C42

InChI

InChI=1S/C26H30N2O4/c1-26(2,3)28(17-24(29)27-16-19-10-8-14-31-19)25(30)21-15-18-9-4-6-12-22(18)32-23-13-7-5-11-20(21)23/h4-7,9,11-13,15,19H,8,10,14,16-17H2,1-3H3,(H,27,29)