[(2S)-butan-2-yl]-[3-(4-methoxycarbonylphenoxy)propyl]azanium

Systemtic Name: [(2S)-butan-2-yl]-[3-(4-methoxycarbonylphenoxy)propyl]azanium Openeye Name: 3-(4-methoxycarbonylphenoxy)propyl-[(1S)-1-methylpropyl]ammonium CAS Name: [(2S)-butan-2-yl]-[3-(4-methoxycarbonylphenoxy)propyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[3-(4-methoxycarbonylphenoxy)propyl]azanium Traditional Name: 3-(4-carbomethoxyphenoxy)propyl-[(1S)-1-methylpropyl]ammonium Formula: C15H24NO3+ MolecularWeight: 266.35596

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CCCOC1=CC=C(C=C1)C(=O)OC

Isomeric SMILES

CC[C@H](C)[NH2+]CCCOC1=CC=C(C=C1)C(=O)OC

InChI

InChI=1S/C15H23NO3/c1-4-12(2)16-10-5-11-19-14-8-6-13(7-9-14)15(17)18-3/h6-9,12,16H,4-5,10-11H2,1-3H3/p+1/t12-/m0/s1