8-[[2-(oxan-4-yl)ethylamino]methyl]-5,6-dihydrobenzo[b][1]benzoxepine-3-carboxamide

Systemtic Name: 8-[[2-(oxan-4-yl)ethylamino]methyl]-5,6-dihydrobenzo[b][1]benzoxepine-3-carboxamide Openeye Name: 8-[(2-tetrahydropyran-4-ylethylamino)methyl]-5,6-dihydrobenzo[b][1]benzoxepine-3-carboxamide CAS Name: 8-[[2-(4-oxanyl)ethylamino]methyl]-5,6-dihydrobenzo[b][1]benzoxepin-3-carboxamide IUPAC Name: 8-[[2-(oxan-4-yl)ethylamino]methyl]-5,6-dihydrobenzo[b][1]benzoxepine-3-carboxamide Traditional Name: 8-[(2-tetrahydropyran-4-ylethylamino)methyl]-5,6-dihydrobenzo[b][1]benzoxepin-3-carboxamide Formula: C23H28N2O3 MolecularWeight: 380.48002

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1CCNCC2=CC3=C(C=C2)OC4=C(CC3)C=C(C=C4)C(=O)N

Isomeric SMILES

C1COCCC1CCNCC2=CC3=C(C=C2)OC4=C(CC3)C=C(C=C4)C(=O)N

InChI

InChI=1S/C23H28N2O3/c24-23(26)20-4-6-22-19(14-20)3-2-18-13-17(1-5-21(18)28-22)15-25-10-7-16-8-11-27-12-9-16/h1,4-6,13-14,16,25H,2-3,7-12,15H2,(H2,24,26)