(2,3-dimethoxyphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone

Systemtic Name: (2,3-dimethoxyphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Openeye Name: (2,3-dimethoxyphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone CAS Name: (2,3-dimethoxyphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone IUPAC Name: (2,3-dimethoxyphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Traditional Name: (2,3-dimethoxyphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Formula: C15H23N2O3+ MolecularWeight: 279.35472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O3/c1-16-8-5-9-17(11-10-16)15(18)12-6-4-7-13(19-2)14(12)20-3/h4,6-7H,5,8-11H2,1-3H3/p+1