3-(phenylmethoxymethyl)-1-(phenylmethyl)azepane

Systemtic Name: 3-(phenylmethoxymethyl)-1-(phenylmethyl)azepane Openeye Name: 1-benzyl-3-(benzyloxymethyl)azepane CAS Name: 3-(phenylmethoxymethyl)-1-(phenylmethyl)azepane IUPAC Name: 1-benzyl-3-(phenylmethoxymethyl)azepane Traditional Name: 3-(benzoxymethyl)-1-benzyl-azepane Formula: C21H27NO MolecularWeight: 309.44518

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC(C1)COCC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

C1CCN(CC(C1)COCC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C21H27NO/c1-3-9-19(10-4-1)15-22-14-8-7-13-21(16-22)18-23-17-20-11-5-2-6-12-20/h1-6,9-12,21H,7-8,13-18H2