(6R)-4-methyl-1-(oxan-4-ylmethyl)-6-phenylmethoxy-1,4-diazepan-4-ium-2-one

Systemtic Name: (6R)-4-methyl-1-(oxan-4-ylmethyl)-6-phenylmethoxy-1,4-diazepan-4-ium-2-one Openeye Name: (6R)-6-benzyloxy-4-methyl-1-(tetrahydropyran-4-ylmethyl)-1,4-diazepan-4-ium-2-one CAS Name: (6R)-4-methyl-1-(4-oxanylmethyl)-6-phenylmethoxy-1,4-diazepan-4-ium-2-one IUPAC Name: (6R)-4-methyl-1-(oxan-4-ylmethyl)-6-phenylmethoxy-1,4-diazepan-4-ium-2-one Traditional Name: (6R)-6-benzoxy-4-methyl-1-(tetrahydropyran-4-ylmethyl)-1,4-diazepan-4-ium-2-one Formula: C19H29N2O3+ MolecularWeight: 333.44516

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC(CN(C(=O)C1)CC2CCOCC2)OCC3=CC=CC=C3

Isomeric SMILES

C[NH+]1C[C@@H](CN(C(=O)C1)CC2CCOCC2)OCC3=CC=CC=C3

InChI

InChI=1S/C19H28N2O3/c1-20-12-18(24-15-17-5-3-2-4-6-17)13-21(19(22)14-20)11-16-7-9-23-10-8-16/h2-6,16,18H,7-15H2,1H3/p+1/t18-/m0/s1