3-(2,2-dimethylpropyl)-7-hexoxy-2,3,4,5-tetrahydro-2-benzazepin-1-one

Systemtic Name: 3-(2,2-dimethylpropyl)-7-hexoxy-2,3,4,5-tetrahydro-2-benzazepin-1-one Openeye Name: 3-(2,2-dimethylpropyl)-7-hexoxy-2,3,4,5-tetrahydro-2-benzazepin-1-one CAS Name: 3-(2,2-dimethylpropyl)-7-hexoxy-2,3,4,5-tetrahydro-2-benzazepin-1-one IUPAC Name: 3-(2,2-dimethylpropyl)-7-hexoxy-2,3,4,5-tetrahydro-2-benzazepin-1-one Traditional Name: 7-hexoxy-3-neopentyl-2,3,4,5-tetrahydro-2-benzazepin-1-one Formula: C21H33NO2 MolecularWeight: 331.49222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC2=C(C=C1)C(=O)NC(CC2)CC(C)(C)C

Isomeric SMILES

CCCCCCOC1=CC2=C(C=C1)C(=O)NC(CC2)CC(C)(C)C

InChI

InChI=1S/C21H33NO2/c1-5-6-7-8-13-24-18-11-12-19-16(14-18)9-10-17(22-20(19)23)15-21(2,3)4/h11-12,14,17H,5-10,13,15H2,1-4H3,(H,22,23)