(2-methoxyphenyl)methyl-[(2R)-1-(3-methylbutylamino)-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: (2-methoxyphenyl)methyl-[(2R)-1-(3-methylbutylamino)-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1R)-2-(isopentylamino)-1-methyl-2-oxo-ethyl]-[(2-methoxyphenyl)methyl]ammonium CAS Name: (2-methoxyphenyl)methyl-[(2R)-1-(3-methylbutylamino)-1-oxopropan-2-yl]ammonium IUPAC Name: (2-methoxyphenyl)methyl-[(2R)-1-(3-methylbutylamino)-1-oxopropan-2-yl]azanium Traditional Name: [(1R)-2-(isoamylamino)-2-keto-1-methyl-ethyl]-o-anisyl-ammonium Formula: C16H27N2O2+ MolecularWeight: 279.39778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C(C)[NH2+]CC1=CC=CC=C1OC

Isomeric SMILES

C[C@H](C(=O)NCCC(C)C)[NH2+]CC1=CC=CC=C1OC

InChI

InChI=1S/C16H26N2O2/c1-12(2)9-10-17-16(19)13(3)18-11-14-7-5-6-8-15(14)20-4/h5-8,12-13,18H,9-11H2,1-4H3,(H,17,19)/p+1/t13-/m1/s1