[2-(butylcarbamoylamino)-2-oxidanylidene-ethyl]-[(5-chloranyl-2-methoxy-phenyl)methyl]-methyl-azanium

Systemtic Name: [2-(butylcarbamoylamino)-2-oxidanylidene-ethyl]-[(5-chloranyl-2-methoxy-phenyl)methyl]-methyl-azanium Openeye Name: [2-(butylcarbamoylamino)-2-oxo-ethyl]-[(5-chloro-2-methoxy-phenyl)methyl]-methyl-ammonium CAS Name: [2-[[butylamino(oxo)methyl]amino]-2-oxoethyl]-[(5-chloro-2-methoxyphenyl)methyl]-methylammonium IUPAC Name: [2-(butylcarbamoylamino)-2-oxoethyl]-[(5-chloro-2-methoxyphenyl)methyl]-methylazanium Traditional Name: [2-(butylcarbamoylamino)-2-keto-ethyl]-(5-chloro-2-methoxy-benzyl)-methyl-ammonium Formula: C16H25ClN3O3+ MolecularWeight: 342.841

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)C[NH+](C)CC1=C(C=CC(=C1)Cl)OC

Isomeric SMILES

CCCCNC(=O)NC(=O)C[NH+](C)CC1=C(C=CC(=C1)Cl)OC

InChI

InChI=1S/C16H24ClN3O3/c1-4-5-8-18-16(22)19-15(21)11-20(2)10-12-9-13(17)6-7-14(12)23-3/h6-7,9H,4-5,8,10-11H2,1-3H3,(H2,18,19,21,22)/p+1