(6R)-6-methoxy-1-(phenylmethyl)-4-(pyridin-3-ylmethyl)-1,4-diazepan-4-ium-2-one

Systemtic Name: (6R)-6-methoxy-1-(phenylmethyl)-4-(pyridin-3-ylmethyl)-1,4-diazepan-4-ium-2-one Openeye Name: (6R)-1-benzyl-6-methoxy-4-(3-pyridylmethyl)-1,4-diazepan-4-ium-2-one CAS Name: (6R)-6-methoxy-1-(phenylmethyl)-4-(3-pyridinylmethyl)-1,4-diazepan-4-ium-2-one IUPAC Name: (6R)-1-benzyl-6-methoxy-4-(pyridin-3-ylmethyl)-1,4-diazepan-4-ium-2-one Traditional Name: (6R)-1-benzyl-6-methoxy-4-(3-pyridylmethyl)-1,4-diazepan-4-ium-2-one Formula: C19H24N3O2+ MolecularWeight: 326.41276

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Descriptors Computed from Structure

Canonical SMILES:

COC1C[NH+](CC(=O)N(C1)CC2=CC=CC=C2)CC3=CN=CC=C3

Isomeric SMILES

CO[C@H]1C[NH+](CC(=O)N(C1)CC2=CC=CC=C2)CC3=CN=CC=C3

InChI

InChI=1S/C19H23N3O2/c1-24-18-13-21(11-17-8-5-9-20-10-17)15-19(23)22(14-18)12-16-6-3-2-4-7-16/h2-10,18H,11-15H2,1H3/p+1/t18-/m0/s1