[4-(furan-2-ylmethyl)-1,4-diazepan-1-yl]-[2-(4-methylphenoxy)pyridin-3-yl]methanone

Systemtic Name: [4-(furan-2-ylmethyl)-1,4-diazepan-1-yl]-[2-(4-methylphenoxy)pyridin-3-yl]methanone Openeye Name: [4-(2-furylmethyl)-1,4-diazepan-1-yl]-[2-(4-methylphenoxy)-3-pyridyl]methanone CAS Name: [4-(2-furanylmethyl)-1,4-diazepan-1-yl]-[2-(4-methylphenoxy)-3-pyridinyl]methanone IUPAC Name: [4-(furan-2-ylmethyl)-1,4-diazepan-1-yl]-[2-(4-methylphenoxy)pyridin-3-yl]methanone Traditional Name: [4-(2-furfuryl)-1,4-diazepan-1-yl]-[2-(4-methylphenoxy)-3-pyridyl]methanone Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=C(C=CC=N2)C(=O)N3CCCN(CC3)CC4=CC=CO4

Isomeric SMILES

CC1=CC=C(C=C1)OC2=C(C=CC=N2)C(=O)N3CCCN(CC3)CC4=CC=CO4

InChI

InChI=1S/C23H25N3O3/c1-18-7-9-19(10-8-18)29-22-21(6-2-11-24-22)23(27)26-13-4-12-25(14-15-26)17-20-5-3-16-28-20/h2-3,5-11,16H,4,12-15,17H2,1H3