2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-1-[4-(oxolan-2-ylmethyl)-1,4-diazepan-1-yl]ethanone

Systemtic Name: 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-1-[4-(oxolan-2-ylmethyl)-1,4-diazepan-1-yl]ethanone Openeye Name: 2-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]-1-[4-(tetrahydrofuran-2-ylmethyl)-1,4-diazepan-1-yl]ethanone CAS Name: 2-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]-1-[4-(2-oxolanylmethyl)-1,4-diazepan-1-yl]ethanone IUPAC Name: 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-1-[4-(oxolan-2-ylmethyl)-1,4-diazepan-1-yl]ethanone Traditional Name: 2-(2,2-dimethylcoumaran-7-yl)oxy-1-[4-(tetrahydrofurfuryl)-1,4-diazepan-1-yl]ethanone Formula: C22H32N2O4 MolecularWeight: 388.50048

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C(=CC=C2)OCC(=O)N3CCCN(CC3)CC4CCCO4)C

Isomeric SMILES

CC1(CC2=C(O1)C(=CC=C2)OCC(=O)N3CCCN(CC3)CC4CCCO4)C

InChI

InChI=1S/C22H32N2O4/c1-22(2)14-17-6-3-8-19(21(17)28-22)27-16-20(25)24-10-5-9-23(11-12-24)15-18-7-4-13-26-18/h3,6,8,18H,4-5,7,9-16H2,1-2H3