N-[2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-6-(1,4-oxazepan-4-yl)pyridine-3-carboxamide

Systemtic Name: N-[2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-6-(1,4-oxazepan-4-yl)pyridine-3-carboxamide Openeye Name: N-[2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-6-(1,4-oxazepan-4-yl)pyridine-3-carboxamide CAS Name: N-[2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-6-(1,4-oxazepan-4-yl)-3-pyridinecarboxamide IUPAC Name: N-[2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-6-(1,4-oxazepan-4-yl)pyridine-3-carboxamide Traditional Name: N-[2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-6-(1,4-oxazepan-4-yl)nicotinamide Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCOC1)C2=NC=C(C=C2)C(=O)NCCC3COC4=CC=CC=C4O3

Isomeric SMILES

C1CN(CCOC1)C2=NC=C(C=C2)C(=O)NCCC3COC4=CC=CC=C4O3

InChI

InChI=1S/C21H25N3O4/c25-21(16-6-7-20(23-14-16)24-10-3-12-26-13-11-24)22-9-8-17-15-27-18-4-1-2-5-19(18)28-17/h1-2,4-7,14,17H,3,8-13,15H2,(H,22,25)