(5-chloranyl-2-methoxy-phenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone

Systemtic Name: (5-chloranyl-2-methoxy-phenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Openeye Name: (5-chloro-2-methoxy-phenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone CAS Name: (5-chloro-2-methoxyphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone IUPAC Name: (5-chloro-2-methoxyphenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Traditional Name: (5-chloro-2-methoxy-phenyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Formula: C14H20ClN2O2+ MolecularWeight: 283.7738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19ClN2O2/c1-16-6-3-7-17(9-8-16)14(18)12-10-11(15)4-5-13(12)19-2/h4-5,10H,3,6-9H2,1-2H3/p+1