(4-methyl-1,4-diazepan-4-ium-1-yl)-(2-phenylmethoxyphenyl)methanone

Systemtic Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-(2-phenylmethoxyphenyl)methanone Openeye Name: (2-benzyloxyphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone CAS Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-(2-phenylmethoxyphenyl)methanone IUPAC Name: (4-methyl-1,4-diazepan-4-ium-1-yl)-(2-phenylmethoxyphenyl)methanone Traditional Name: (2-benzoxyphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Formula: C20H25N2O2+ MolecularWeight: 325.4247

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C(=O)C2=CC=CC=C2OCC3=CC=CC=C3

Isomeric SMILES

C[NH+]1CCCN(CC1)C(=O)C2=CC=CC=C2OCC3=CC=CC=C3

InChI

InChI=1S/C20H24N2O2/c1-21-12-7-13-22(15-14-21)20(23)18-10-5-6-11-19(18)24-16-17-8-3-2-4-9-17/h2-6,8-11H,7,12-16H2,1H3/p+1