2,3-dihydro-1,4-benzodioxin-3-yl-[4-[(6-methylpyridin-2-yl)methyl]-1,4-diazepan-1-yl]methanone

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-3-yl-[4-[(6-methylpyridin-2-yl)methyl]-1,4-diazepan-1-yl]methanone Openeye Name: 2,3-dihydro-1,4-benzodioxin-3-yl-[4-[(6-methyl-2-pyridyl)methyl]-1,4-diazepan-1-yl]methanone CAS Name: 2,3-dihydro-1,4-benzodioxin-3-yl-[4-[(6-methyl-2-pyridinyl)methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: 2,3-dihydro-1,4-benzodioxin-3-yl-[4-[(6-methylpyridin-2-yl)methyl]-1,4-diazepan-1-yl]methanone Traditional Name: 2,3-dihydro-1,4-benzodioxin-3-yl-[4-[(6-methyl-2-pyridyl)methyl]-1,4-diazepan-1-yl]methanone Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CN2CCCN(CC2)C(=O)C3COC4=CC=CC=C4O3

Isomeric SMILES

CC1=NC(=CC=C1)CN2CCCN(CC2)C(=O)C3COC4=CC=CC=C4O3

InChI

InChI=1S/C21H25N3O3/c1-16-6-4-7-17(22-16)14-23-10-5-11-24(13-12-23)21(25)20-15-26-18-8-2-3-9-19(18)27-20/h2-4,6-9,20H,5,10-15H2,1H3