(5-bromanyl-2-methoxy-phenyl)methyl-[2-(cyclopentylcarbamoylamino)-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (5-bromanyl-2-methoxy-phenyl)methyl-[2-(cyclopentylcarbamoylamino)-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (5-bromo-2-methoxy-phenyl)methyl-[2-(cyclopentylcarbamoylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (5-bromo-2-methoxyphenyl)methyl-[2-[[(cyclopentylamino)-oxomethyl]amino]-2-oxoethyl]-methylammonium IUPAC Name: (5-bromo-2-methoxyphenyl)methyl-[2-(cyclopentylcarbamoylamino)-2-oxoethyl]-methylazanium Traditional Name: (5-bromo-2-methoxy-benzyl)-[2-(cyclopentylcarbamoylamino)-2-keto-ethyl]-methyl-ammonium Formula: C17H25BrN3O3+ MolecularWeight: 399.3027

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(C=CC(=C1)Br)OC)CC(=O)NC(=O)NC2CCCC2

Isomeric SMILES

C[NH+](CC1=C(C=CC(=C1)Br)OC)CC(=O)NC(=O)NC2CCCC2

InChI

InChI=1S/C17H24BrN3O3/c1-21(10-12-9-13(18)7-8-15(12)24-2)11-16(22)20-17(23)19-14-5-3-4-6-14/h7-9,14H,3-6,10-11H2,1-2H3,(H2,19,20,22,23)/p+1