(3-methoxyphenyl)methyl-methyl-[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl]azanium

Systemtic Name: (3-methoxyphenyl)methyl-methyl-[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl]azanium Openeye Name: [2-(isopentylcarbamoylamino)-2-oxo-ethyl]-[(3-methoxyphenyl)methyl]-methyl-ammonium CAS Name: (3-methoxyphenyl)methyl-methyl-[2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl]ammonium IUPAC Name: (3-methoxyphenyl)methyl-methyl-[2-(3-methylbutylcarbamoylamino)-2-oxoethyl]azanium Traditional Name: [2-(isoamylcarbamoylamino)-2-keto-ethyl]-m-anisyl-methyl-ammonium Formula: C17H28N3O3+ MolecularWeight: 322.42252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27N3O3/c1-13(2)8-9-18-17(22)19-16(21)12-20(3)11-14-6-5-7-15(10-14)23-4/h5-7,10,13H,8-9,11-12H2,1-4H3,(H2,18,19,21,22)/p+1