6-(2-azanyl-2-oxidanyl-octoxy)-1,3,4,5-tetrahydro-1-benzazepin-2-one

Systemtic Name: 6-(2-azanyl-2-oxidanyl-octoxy)-1,3,4,5-tetrahydro-1-benzazepin-2-one Openeye Name: 6-(2-amino-2-hydroxy-octoxy)-1,3,4,5-tetrahydro-1-benzazepin-2-one CAS Name: 6-(2-amino-2-hydroxyoctoxy)-1,3,4,5-tetrahydro-1-benzazepin-2-one IUPAC Name: 6-(2-amino-2-hydroxyoctoxy)-1,3,4,5-tetrahydro-1-benzazepin-2-one Traditional Name: 6-(2-amino-2-hydroxy-octoxy)-1,3,4,5-tetrahydro-1-benzazepin-2-one Formula: C18H28N2O3 MolecularWeight: 320.42652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(COC1=CC=CC2=C1CCCC(=O)N2)(N)O

Isomeric SMILES

CCCCCCC(COC1=CC=CC2=C1CCCC(=O)N2)(N)O

InChI

InChI=1S/C18H28N2O3/c1-2-3-4-5-12-18(19,22)13-23-16-10-7-9-15-14(16)8-6-11-17(21)20-15/h7,9-10,22H,2-6,8,11-13,19H2,1H3,(H,20,21)